#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3hl9 s ALA 11 N 0.00 2.33 0.18 0.00 0.00 -1.26 -4.72 121.76 118.29 3hl9 s ALA 11 Ca 0.00 0.65 -0.20 0.00 0.00 0.00 0.00 51.96 52.40 3hl9 s ALA 11 Cb 0.00 -3.37 0.11 0.00 0.00 0.00 0.00 23.12 19.87 3hl9 s ALA 11 CO 0.00 -1.50 1.60 -0.44 0.00 0.00 0.00 175.76 175.42 3hl9 h ASP 12 N -0.13 -1.00 -0.29 0.00 5.19 -2.00 0.12 116.42 118.31 3hl9 h ASP 12 Ca -0.47 0.20 -0.10 0.00 -0.62 0.00 0.00 57.03 56.05 3hl9 h ASP 12 Cb 1.26 0.50 -0.02 0.00 0.18 0.00 0.00 39.33 41.26 3hl9 h ASP 12 CO 0.52 -0.29 -0.15 -0.65 -3.12 0.00 0.00 179.24 175.55 3hl9 h PRO 13 N -0.17 0.72 -0.02 3.56 0.11 -1.93 -2.99 132.00 131.29 3hl9 h PRO 13 Ca 0.22 -0.25 -0.12 0.00 0.11 0.00 0.00 66.00 65.95 3hl9 h PRO 13 Cb 0.52 -0.05 -0.02 0.00 0.11 0.00 0.00 31.00 31.56 3hl9 h PRO 13 CO -0.60 0.84 -0.55 0.28 -0.21 0.00 0.00 178.00 177.75 3hl9 h VAL 14 N 0.65 1.39 0.08 3.15 2.07 -1.35 -0.95 116.25 121.29 3hl9 h VAL 14 Ca 0.11 -1.89 -0.27 0.00 0.82 0.00 0.00 66.70 65.46 3hl9 h VAL 14 Cb 0.62 2.00 0.02 0.00 -1.52 0.00 0.00 31.29 32.41 3hl9 h VAL 14 CO 0.04 0.54 -1.15 -0.37 0.02 0.00 0.00 177.57 176.66 3hl9 h VAL 15 N 0.04 1.34 -0.52 2.57 -1.51 -0.86 -1.83 116.25 115.48 3hl9 h VAL 15 Ca -0.00 -2.51 -0.01 0.00 -1.23 0.00 0.00 66.70 62.95 3hl9 h VAL 15 Cb 0.99 2.61 -0.02 0.00 -2.13 0.00 0.00 31.29 32.74 3hl9 h VAL 15 CO 0.07 0.76 0.30 -0.07 -1.23 0.00 0.00 177.57 177.40 3hl9 h LEU 16 N 0.26 0.64 0.34 4.19 3.38 -1.44 -2.24 115.31 120.43 3hl9 h LEU 16 Ca -0.15 -0.07 -0.01 0.00 0.09 0.00 0.00 57.88 57.74 3hl9 h LEU 16 Cb 1.81 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 42.39 3hl9 h LEU 16 CO 0.21 0.53 -0.23 -0.03 0.09 0.00 0.00 178.44 179.01 3hl9 h MET 17 N 0.70 -0.53 -0.88 1.13 4.05 -1.22 -1.51 114.93 116.66 3hl9 h MET 17 Ca 0.19 0.04 0.06 0.00 -0.28 0.00 0.00 59.70 59.70 3hl9 h MET 17 Cb 0.02 0.12 -0.06 0.00 -0.80 0.00 0.00 31.60 30.88 3hl9 h MET 17 CO -0.03 -0.36 0.56 0.93 0.23 0.00 0.00 176.91 178.24 3hl9 h GLU 18 N -0.55 0.99 -0.00 0.39 5.08 -1.17 -1.07 114.58 118.25 3hl9 h GLU 18 Ca -0.03 -0.06 -0.16 0.00 -1.00 0.00 0.00 59.36 58.11 3hl9 h GLU 18 Cb 0.47 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.47 3hl9 h GLU 18 CO 0.02 0.66 -0.77 1.79 -1.00 0.00 0.00 179.01 179.71 3hl9 h THR 19 N 1.02 1.55 -0.44 1.13 1.35 -1.40 -2.09 112.91 114.03 3hl9 h THR 19 Ca 0.38 -2.62 -0.01 0.00 -0.55 0.00 0.00 66.41 63.61 3hl9 h THR 19 Cb 0.15 2.41 -0.02 0.00 -1.73 0.00 0.00 68.15 68.96 3hl9 h THR 19 CO -0.16 0.75 0.21 0.00 -0.25 0.00 0.00 175.52 176.07 3hl9 h ALA 20 N 1.22 1.56 -0.27 6.62 0.00 -0.14 0.72 119.26 128.96 3hl9 h ALA 20 Ca -0.01 -0.09 -0.07 0.00 0.00 0.00 0.00 54.91 54.74 3hl9 h ALA 20 Cb 1.36 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.96 3hl9 h ALA 20 CO 0.10 0.36 -0.10 0.74 0.00 0.00 0.00 179.25 180.35 3hl9 h PHE 21 N 0.61 0.62 -0.06 0.00 -1.00 -1.13 -2.79 116.94 113.19 3hl9 h PHE 21 Ca 0.15 -0.15 -0.08 0.00 2.81 0.00 0.00 57.97 60.71 3hl9 h PHE 21 Cb 0.06 -0.15 -0.01 0.00 3.61 0.00 0.00 35.95 39.46 3hl9 h PHE 21 CO 0.00 0.78 -0.34 -0.09 -1.61 0.00 0.00 178.31 177.06 3hl9 h ARG 22 N 0.29 0.11 0.16 1.51 9.65 -0.58 -1.66 114.38 123.87 3hl9 h ARG 22 Ca 0.06 -0.04 -0.01 0.00 -1.10 0.00 0.00 59.98 58.89 3hl9 h ARG 22 Cb 0.60 -0.01 0.00 0.00 -1.39 0.00 0.00 29.97 29.18 3hl9 h ARG 22 CO 0.03 0.44 -0.08 -0.22 2.80 0.00 0.00 179.97 182.95 3hl9 h LYS 23 N 0.10 -0.21 -0.45 0.20 3.64 0.37 -2.92 116.57 117.31 3hl9 h LYS 23 Ca 0.01 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.40 3hl9 h LYS 23 Cb 0.65 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.50 3hl9 h LYS 23 CO 0.05 -0.09 0.24 0.00 -2.27 0.00 0.00 179.45 177.38 3hl9 h ALA 24 N 0.56 1.58 -0.42 5.00 0.00 -1.09 -0.73 119.26 124.16 3hl9 h ALA 24 Ca -0.02 -0.08 -0.10 0.00 0.00 0.00 0.00 54.91 54.71 3hl9 h ALA 24 Cb 0.22 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 3hl9 h ALA 24 CO 0.04 0.35 -0.12 0.28 0.00 0.00 0.00 179.25 179.80 3hl9 h VAL 25 N 0.62 1.28 0.13 0.00 2.07 -1.32 -1.35 116.25 117.66 3hl9 h VAL 25 Ca 0.16 -1.23 -0.30 0.00 0.82 0.00 0.00 66.70 66.15 3hl9 h VAL 25 Cb 0.03 1.20 0.03 0.00 -1.52 0.00 0.00 31.29 31.03 3hl9 h VAL 25 CO -0.03 0.42 -1.25 0.50 0.02 0.00 0.00 177.57 177.22 3hl9 h LYS 26 N 0.64 0.60 -0.98 1.57 3.64 -1.21 -3.05 116.57 117.78 3hl9 h LYS 26 Ca 0.10 -0.82 -0.02 0.00 -1.27 0.00 0.00 60.65 58.65 3hl9 h LYS 26 Cb 0.66 0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 32.74 3hl9 h LYS 26 CO 0.05 1.37 0.02 -1.13 -2.27 0.00 0.00 179.45 177.49 3hl9 n SER 27 N -3.77 2.12 -1.12 4.20 3.41 -0.34 -4.86 113.62 113.26 3hl9 n SER 27 Ca -0.13 -2.10 -0.12 0.00 -0.26 0.00 0.00 58.87 56.26 3hl9 n SER 27 Cb 0.99 -0.52 -0.05 0.00 -0.26 0.00 0.00 64.21 64.37 3hl9 n SER 27 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 3hl9 n ARG 28 N 0.19 -1.49 -0.02 4.33 3.00 -1.15 -4.85 116.66 116.67 3hl9 n ARG 28 Ca 0.03 0.79 -0.17 0.00 -0.01 0.00 0.00 57.85 58.50 3hl9 n ARG 28 Cb 0.44 -5.01 -0.09 0.00 0.00 0.00 0.00 32.46 27.80 3hl9 n ARG 28 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.63 179.59 3hl9 h GLN 29 N 0.00 0.51 -5.80 5.56 4.20 -1.49 -3.44 115.11 114.65 3hl9 h GLN 29 Ca -0.25 -0.45 -0.51 0.00 0.06 0.00 0.00 58.65 57.51 3hl9 h GLN 29 Cb 0.95 0.10 -0.14 0.00 0.30 0.00 0.00 27.48 28.69 3hl9 h GLN 29 CO 0.36 1.08 -0.74 0.96 -0.67 0.00 0.00 178.83 179.82 3hl9 s ILE 30 N -3.55 2.00 0.14 2.54 -4.36 -0.97 -4.93 121.20 112.06 3hl9 s ILE 30 Ca -0.13 -2.27 -0.01 0.00 -0.26 0.00 0.00 60.65 57.98 3hl9 s ILE 30 Cb 0.05 -2.13 -0.18 0.00 1.25 0.00 0.00 42.46 41.45 3hl9 s ILE 30 CO 0.83 -0.52 1.31 -0.65 0.24 0.00 0.00 174.94 176.16 3hl9 h PRO 31 N 2.48 0.28 0.00 0.37 0.11 -1.87 -3.39 132.00 129.97 3hl9 h PRO 31 Ca -0.39 -0.33 0.00 0.00 0.11 0.00 0.00 66.00 65.40 3hl9 h PRO 31 Cb 1.23 0.10 0.00 0.00 0.11 0.00 0.00 31.00 32.44 3hl9 h PRO 31 CO 0.61 1.05 0.00 0.41 -0.21 0.00 0.00 178.00 179.86 3hl9 n GLY 32 N 1.01 0.80 3.61 -0.55 0.00 -1.25 -0.43 105.19 108.39 3hl9 n GLY 32 Ca -0.05 -1.14 -0.14 0.00 0.00 0.00 0.00 46.02 44.69 3hl9 n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hl9 s ALA 33 N -2.00 -1.75 -0.20 4.61 0.00 0.83 -4.64 121.76 118.61 3hl9 s ALA 33 Ca 0.00 1.96 -0.06 0.00 0.00 0.00 0.00 51.96 53.86 3hl9 s ALA 33 Cb 0.00 -1.10 -0.03 0.00 0.00 0.00 0.00 23.12 21.99 3hl9 s ALA 33 CO 0.00 -0.34 0.02 0.08 0.00 0.00 0.00 175.76 175.52 3hl9 s VAL 34 N 0.29 4.16 0.09 0.00 1.01 -0.59 0.35 120.40 125.70 3hl9 s VAL 34 Ca -0.01 -0.24 0.07 0.00 0.00 0.00 0.00 61.98 61.80 3hl9 s VAL 34 Cb -0.05 -2.89 -0.03 0.00 0.00 0.00 0.00 36.38 33.41 3hl9 s VAL 34 CO 0.01 0.42 -0.19 0.27 0.00 0.00 0.00 175.10 175.62 3hl9 s ILE 35 N 0.93 1.57 -0.18 2.22 -4.36 -0.74 -0.78 121.20 119.85 3hl9 s ILE 35 Ca 0.02 -1.43 -0.14 0.00 -0.26 0.00 0.00 60.65 58.83 3hl9 s ILE 35 Cb -0.14 -1.43 0.05 0.00 1.25 0.00 0.00 42.46 42.19 3hl9 s ILE 35 CO 0.02 -0.06 0.46 -0.04 0.24 0.00 0.00 174.94 175.56 3hl9 s MET 36 N -1.75 0.51 0.04 0.37 -1.94 -0.66 -1.68 119.30 114.18 3hl9 s MET 36 Ca 0.05 0.71 0.03 0.00 -1.71 0.00 0.00 55.69 54.77 3hl9 s MET 36 Cb -0.10 0.17 -0.02 0.00 2.01 0.00 0.00 34.83 36.89 3hl9 s MET 36 CO 0.03 -0.10 -0.09 0.00 -0.01 0.00 0.00 175.02 174.86 3hl9 s ALA 37 N 0.65 0.65 0.09 3.03 0.00 -0.77 -1.07 121.76 124.34 3hl9 s ALA 37 Ca -0.03 -0.74 -0.13 0.00 0.00 0.00 0.00 51.96 51.06 3hl9 s ALA 37 Cb -0.05 0.00 0.02 0.00 0.00 0.00 0.00 23.12 23.09 3hl9 s ALA 37 CO -0.04 0.02 0.29 1.03 0.00 0.00 0.00 175.76 177.06 3hl9 s ARG 38 N -1.44 0.92 0.24 0.00 3.00 -0.86 -2.30 118.95 118.51 3hl9 s ARG 38 Ca -0.07 -0.76 0.05 0.00 0.00 0.00 0.00 55.73 54.95 3hl9 s ARG 38 Cb -0.09 0.39 -0.05 0.00 0.00 0.00 0.00 34.95 35.20 3hl9 s ARG 38 CO 0.01 -0.32 -0.05 0.16 0.00 0.00 0.00 175.30 175.10 3hl9 s ASP 39 N -2.65 2.30 0.55 0.23 -4.77 -1.24 -1.25 116.67 109.84 3hl9 s ASP 39 Ca 0.02 -1.17 0.23 0.00 -3.30 0.00 0.00 52.55 48.33 3hl9 s ASP 39 Cb 0.02 -0.08 1.45 0.00 -1.09 0.00 0.00 42.92 43.22 3hl9 s ASP 39 CO -0.10 -0.39 2.11 0.00 0.70 0.00 0.00 175.17 177.49 3hl9 h ALA 40 N 2.42 2.04 0.00 2.11 0.00 -1.38 -2.30 119.26 122.16 3hl9 h ALA 40 Ca -0.39 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.52 3hl9 h ALA 40 Cb 1.22 0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.03 3hl9 h ALA 40 CO 0.65 -0.24 0.00 0.43 0.00 0.00 0.00 179.25 180.10 3hl9 n SER 41 N -4.26 0.22 0.00 0.00 7.64 -1.26 -4.80 113.62 111.16 3hl9 n SER 41 Ca 0.01 0.57 0.00 0.00 1.01 0.00 0.00 58.87 60.46 3hl9 n SER 41 Cb 0.28 -0.61 0.00 0.00 -1.01 0.00 0.00 64.21 62.87 3hl9 n SER 41 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3hl9 n GLY 42 N -0.41 1.50 0.18 0.23 0.00 -0.86 -4.88 105.19 100.95 3hl9 n GLY 42 Ca 0.02 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.93 3hl9 n GLY 42 CO 0.00 0.00 0.00 3.45 0.00 0.00 0.00 173.32 176.77 3hl9 h ASN 43 N 0.00 0.52 -2.66 1.61 7.08 -1.89 -3.42 115.58 116.81 3hl9 h ASN 43 Ca 0.00 -0.28 -0.53 0.00 -3.08 0.00 0.00 56.30 52.42 3hl9 h ASN 43 Cb 0.00 -0.14 0.04 0.00 -2.08 0.00 0.00 38.32 36.14 3hl9 h ASN 43 CO 0.00 0.66 1.01 -0.22 -2.08 0.00 0.00 177.43 176.81 3hl9 s LEU 44 N -9.54 4.38 -0.45 6.14 2.96 -1.26 -4.93 118.68 115.98 3hl9 s LEU 44 Ca -0.13 2.68 0.06 0.00 -0.22 0.00 0.00 54.13 56.51 3hl9 s LEU 44 Cb 0.09 -3.58 0.20 0.00 0.50 0.00 0.00 46.19 43.39 3hl9 s LEU 44 CO 0.76 -0.93 0.54 -3.20 -1.32 0.00 0.00 176.35 172.21 3hl9 n ASN 45 N 4.95 -1.57 -4.71 3.68 2.85 -1.26 -3.67 115.26 115.53 3hl9 n ASN 45 Ca 0.16 -2.69 -0.35 0.00 -0.11 0.00 0.00 54.58 51.59 3hl9 n ASN 45 Cb 0.38 0.40 -0.09 0.00 1.24 0.00 0.00 39.78 41.71 3hl9 n ASN 45 CO 0.00 0.00 0.00 -0.47 -2.11 0.00 0.00 177.26 174.68 3hl9 s TYR 46 N 0.19 3.31 -0.30 1.20 5.04 -0.97 -5.03 117.35 120.78 3hl9 s TYR 46 Ca 0.32 0.22 -0.05 0.00 -2.44 0.00 0.00 57.07 55.12 3hl9 s TYR 46 Cb 0.07 -1.94 0.19 0.00 0.35 0.00 0.00 41.96 40.62 3hl9 s TYR 46 CO -0.15 0.41 0.78 -0.08 -1.34 0.00 0.00 175.55 175.17 3hl9 s THR 47 N -0.41 -0.72 -0.05 4.34 -1.32 -1.26 -1.85 115.64 114.37 3hl9 s THR 47 Ca 0.09 0.00 0.01 0.00 -1.21 0.00 0.00 61.69 60.58 3hl9 s THR 47 Cb -0.12 -0.96 0.02 0.00 -1.51 0.00 0.00 72.50 69.93 3hl9 s THR 47 CO 0.02 0.00 -0.06 -0.13 -2.21 0.00 0.00 174.62 172.24 3hl9 s ARG 48 N 2.90 0.97 -0.07 7.08 1.81 -0.68 -5.03 118.95 125.93 3hl9 s ARG 48 Ca 0.12 -0.15 -0.04 0.00 -1.72 0.00 0.00 55.73 53.94 3hl9 s ARG 48 Cb -0.12 -0.95 -0.04 0.00 -0.45 0.00 0.00 34.95 33.39 3hl9 s ARG 48 CO -0.18 -0.07 0.14 0.00 -0.68 0.00 0.00 175.30 174.50 3hl9 s PHE 50 N -1.14 0.79 0.00 0.00 0.08 0.15 -5.00 117.98 112.87 3hl9 s PHE 50 Ca 0.20 -0.19 0.00 0.00 0.12 0.00 0.00 56.93 57.05 3hl9 s PHE 50 Cb -0.12 -0.60 0.00 0.00 -0.57 0.00 0.00 43.02 41.73 3hl9 s PHE 50 CO 0.10 -0.11 0.00 0.41 -0.10 0.00 0.00 175.22 175.52 3hl9 n GLY 51 N 3.45 -1.12 3.82 4.36 0.00 -1.26 -0.12 105.19 114.32 3hl9 n GLY 51 Ca -0.19 -1.23 -0.28 0.00 0.00 0.00 0.00 46.02 44.32 3hl9 n GLY 51 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hl9 s ALA 52 N -1.20 3.66 -0.61 4.61 0.00 0.43 -2.51 121.76 126.15 3hl9 s ALA 52 Ca 0.00 -1.10 0.25 0.00 0.00 0.00 0.00 51.96 51.11 3hl9 s ALA 52 Cb 0.00 -1.48 0.59 0.00 0.00 0.00 0.00 23.12 22.23 3hl9 s ALA 52 CO 0.00 0.61 1.67 0.07 0.00 0.00 0.00 175.76 178.11 3hl9 h ARG 53 N 2.69 0.00 -4.90 0.00 0.11 -1.50 -3.31 114.38 107.47 3hl9 h ARG 53 Ca -0.47 0.00 -0.46 0.00 0.10 0.00 0.00 59.98 59.15 3hl9 h ARG 53 Cb 1.18 0.00 -0.13 0.00 1.11 0.00 0.00 29.97 32.13 3hl9 h ARG 53 CO 0.66 0.00 -0.52 -0.08 0.10 0.00 0.00 179.97 180.13 3hl9 s THR 54 N -3.15 0.16 -0.49 0.08 -1.32 -1.26 -3.11 115.64 106.55 3hl9 s THR 54 Ca 0.09 -2.00 0.13 0.00 -1.21 0.00 0.00 61.69 58.69 3hl9 s THR 54 Cb 0.10 -2.47 -0.15 0.00 -1.51 0.00 0.00 72.50 68.47 3hl9 s THR 54 CO 0.64 0.00 0.49 1.33 -2.21 0.00 0.00 174.62 174.87 3hl9 n VAL 55 N -0.64 0.00 -2.93 5.08 0.24 -1.26 -4.94 118.33 113.88 3hl9 n VAL 55 Ca 0.03 -0.22 -0.41 0.00 -2.04 0.00 0.00 64.34 61.71 3hl9 n VAL 55 Cb 0.63 0.85 -0.04 0.00 -1.47 0.00 0.00 33.84 33.82 3hl9 n VAL 55 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 3hl9 s ARG 56 N -2.33 4.35 0.22 7.34 3.52 -1.26 -4.95 118.95 125.84 3hl9 s ARG 56 Ca 0.03 0.99 -0.30 0.00 -0.13 0.00 0.00 55.73 56.32 3hl9 s ARG 56 Cb 0.09 -3.53 -0.08 0.00 -1.56 0.00 0.00 34.95 29.87 3hl9 s ARG 56 CO 0.53 -0.20 1.11 1.03 -0.81 0.00 0.00 175.30 176.96 3hl9 s ARG 57 N 1.70 4.60 0.00 5.12 0.52 -1.26 -4.83 118.95 124.80 3hl9 s ARG 57 Ca 0.39 1.77 0.00 0.00 -0.52 0.00 0.00 55.73 57.37 3hl9 s ARG 57 Cb -0.17 -3.24 0.00 0.00 0.52 0.00 0.00 34.95 32.06 3hl9 s ARG 57 CO 0.15 0.12 0.00 -0.40 0.02 0.00 0.00 175.30 175.19 3hl9 n ASP 58 N 1.89 -1.13 0.30 0.23 5.75 -1.15 -4.86 116.55 117.60 3hl9 n ASP 58 Ca 0.01 -0.42 0.18 0.00 -0.01 0.00 0.00 54.79 54.56 3hl9 n ASP 58 Cb 0.45 0.00 0.97 0.00 -1.03 0.00 0.00 41.12 41.51 3hl9 n ASP 58 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3hl9 h GLU 59 N 0.00 0.00 -0.55 0.11 3.07 -1.96 -2.92 114.58 112.33 3hl9 h GLU 59 Ca 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.86 3hl9 h GLU 59 Cb 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3hl9 h GLU 59 CO 0.00 0.03 0.00 0.09 -1.40 0.00 0.00 179.01 177.73 3hl9 n ASN 60 N -3.34 4.04 -1.07 1.42 4.13 -1.26 -4.97 115.26 114.21 3hl9 n ASN 60 Ca -0.02 -2.30 -0.14 0.00 1.68 0.00 0.00 54.58 53.80 3hl9 n ASN 60 Cb 0.15 -0.47 -0.06 0.00 -1.54 0.00 0.00 39.78 37.87 3hl9 n ASN 60 CO 0.00 0.00 0.00 -3.20 0.28 0.00 0.00 177.26 174.34 3hl9 n ASN 61 N 0.91 -4.63 -4.28 6.41 5.15 -1.10 -4.99 115.26 112.73 3hl9 n ASN 61 Ca 0.22 0.32 -0.22 0.00 -0.60 0.00 0.00 54.58 54.30 3hl9 n ASN 61 Cb 0.72 -3.36 -0.12 0.00 -0.53 0.00 0.00 39.78 36.49 3hl9 n ASN 61 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 3hl9 s GLN 62 N -3.23 1.11 -0.27 1.20 -2.07 -1.26 -4.97 119.66 110.18 3hl9 s GLN 62 Ca 0.00 -1.21 -0.06 0.00 -1.82 0.00 0.00 55.36 52.27 3hl9 s GLN 62 Cb 0.00 -1.24 -0.01 0.00 -1.09 0.00 0.00 33.01 30.68 3hl9 s GLN 62 CO 0.00 0.27 0.06 -0.48 -1.32 0.00 0.00 175.29 173.82 3hl9 s LEU 63 N -2.16 3.55 0.30 2.60 0.05 -1.26 -2.93 118.68 118.84 3hl9 s LEU 63 Ca 0.08 -0.48 -0.29 0.00 0.05 0.00 0.00 54.13 53.48 3hl9 s LEU 63 Cb -0.08 -1.87 -0.12 0.00 -2.05 0.00 0.00 46.19 42.06 3hl9 s LEU 63 CO 0.04 -0.11 1.42 -0.81 -0.55 0.00 0.00 176.35 176.35 3hl9 n PRO 64 N 4.88 2.31 -3.00 1.48 -0.04 -1.26 -4.75 135.00 134.61 3hl9 n PRO 64 Ca -0.16 0.82 -0.34 0.00 -0.04 0.00 0.00 63.50 63.78 3hl9 n PRO 64 Cb 0.50 -2.49 -0.06 0.00 -0.04 0.00 0.00 33.50 31.40 3hl9 n PRO 64 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 3hl9 s PRO 65 N -1.14 4.20 0.50 0.54 0.04 -1.26 -1.53 135.00 136.36 3hl9 s PRO 65 Ca 0.61 0.92 -0.14 0.00 0.04 0.00 0.00 61.00 62.43 3hl9 s PRO 65 Cb -0.56 -2.53 -0.07 0.00 0.04 0.00 0.00 34.50 31.38 3hl9 s PRO 65 CO 0.55 0.19 0.93 -0.48 0.04 0.00 0.00 177.00 178.23 3hl9 s LEU 66 N -2.65 3.61 0.23 -3.56 0.05 -1.04 -4.48 118.68 110.83 3hl9 s LEU 66 Ca 0.53 1.41 -0.23 0.00 0.05 0.00 0.00 54.13 55.89 3hl9 s LEU 66 Cb -0.13 -4.35 0.04 0.00 -2.05 0.00 0.00 46.19 39.70 3hl9 s LEU 66 CO 0.18 -0.59 0.82 0.00 -0.55 0.00 0.00 176.35 176.21 3hl9 s GLN 67 N -4.24 1.56 0.66 1.48 -2.07 -1.26 -4.64 119.66 111.14 3hl9 s GLN 67 Ca 0.56 -0.86 0.44 0.00 -1.82 0.00 0.00 55.36 53.67 3hl9 s GLN 67 Cb -0.10 0.53 2.36 0.00 -1.09 0.00 0.00 33.01 34.71 3hl9 s GLN 67 CO 0.36 -0.71 2.34 -0.39 -1.32 0.00 0.00 175.29 175.57 3hl9 h VAL 68 N 2.00 0.00 -0.02 3.63 -1.51 -1.98 0.14 116.25 118.51 3hl9 h VAL 68 Ca -0.21 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.23 3hl9 h VAL 68 Cb 1.24 1.02 0.00 0.00 -2.13 0.00 0.00 31.29 31.42 3hl9 h VAL 68 CO 0.24 0.00 -0.07 -0.90 -1.23 0.00 0.00 177.57 175.61 3hl9 n ASP 69 N -3.06 2.39 -4.70 4.19 5.68 -1.26 -1.68 116.55 118.10 3hl9 n ASP 69 Ca -0.03 -1.75 -0.42 0.00 -0.50 0.00 0.00 54.79 52.09 3hl9 n ASP 69 Cb 0.08 0.07 -0.03 0.00 -1.14 0.00 0.00 41.12 40.10 3hl9 n ASP 69 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 3hl9 s THR 70 N -2.09 3.45 0.07 2.12 2.01 0.49 -4.64 115.64 117.05 3hl9 s THR 70 Ca 0.29 0.97 -0.31 0.00 0.31 0.00 0.00 61.69 62.95 3hl9 s THR 70 Cb 0.20 -3.62 -0.07 0.00 0.01 0.00 0.00 72.50 69.02 3hl9 s THR 70 CO 0.36 0.04 1.40 -2.84 -0.69 0.00 0.00 174.62 172.88 3hl9 s PRO 71 N 1.68 4.31 0.02 4.92 0.02 -1.26 -3.98 135.00 140.71 3hl9 s PRO 71 Ca 0.65 2.03 0.02 0.00 0.02 0.00 0.00 61.00 63.72 3hl9 s PRO 71 Cb -0.35 -3.39 -0.02 0.00 0.02 0.00 0.00 34.50 30.77 3hl9 s PRO 71 CO 0.29 -0.49 -0.06 0.00 -0.33 0.00 0.00 177.00 176.41 3hl9 s ARG 73 N -1.03 3.98 0.33 0.00 1.70 -1.26 -1.41 118.95 121.26 3hl9 s ARG 73 Ca -0.07 1.21 0.08 0.00 -0.47 0.00 0.00 55.73 56.48 3hl9 s ARG 73 Cb -0.07 -3.83 0.57 0.00 -0.57 0.00 0.00 34.95 31.05 3hl9 s ARG 73 CO 0.00 -1.03 1.78 -0.07 -1.08 0.00 0.00 175.30 174.90 3hl9 h LEU 74 N 10.55 0.24 0.00 -1.89 3.38 -1.53 -3.45 115.31 122.61 3hl9 h LEU 74 Ca -0.24 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 57.64 3hl9 h LEU 74 Cb 1.09 -0.07 0.00 0.00 0.09 0.00 0.00 40.66 41.77 3hl9 h LEU 74 CO 1.03 0.55 0.00 0.00 0.09 0.00 0.00 178.44 180.11 3hl9 n ALA 75 N -2.48 0.00 0.41 1.53 0.00 -1.25 -1.39 120.51 117.33 3hl9 n ALA 75 Ca -0.01 0.00 0.04 0.00 0.00 0.00 0.00 53.44 53.47 3hl9 n ALA 75 Cb 0.40 0.00 0.21 0.00 0.00 0.00 0.00 19.45 20.06 3hl9 n ALA 75 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3hl9 n SER 76 N 3.33 0.00 -0.22 0.00 7.64 -1.26 -0.62 113.62 122.49 3hl9 n SER 76 Ca 0.00 -0.03 0.15 0.00 1.01 0.00 0.00 58.87 60.00 3hl9 n SER 76 Cb 0.00 -0.14 0.74 0.00 -1.01 0.00 0.00 64.21 63.80 3hl9 n SER 76 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 3hl9 n ALA 77 N -1.14 2.63 0.22 -0.43 0.00 -0.49 -3.74 120.51 117.57 3hl9 n ALA 77 Ca 0.05 -0.31 0.08 0.00 0.00 0.00 0.00 53.44 53.26 3hl9 n ALA 77 Cb 0.04 -1.35 0.50 0.00 0.00 0.00 0.00 19.45 18.64 3hl9 n ALA 77 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3hl9 h THR 78 N 1.06 0.82 -0.87 0.00 2.02 -1.03 -3.36 112.91 111.54 3hl9 h THR 78 Ca 0.00 -1.03 0.13 0.00 0.77 0.00 0.00 66.41 66.27 3hl9 h THR 78 Cb 0.22 1.63 -0.09 0.00 -1.74 0.00 0.00 68.15 68.17 3hl9 h THR 78 CO 0.00 0.25 0.49 0.11 0.37 0.00 0.00 175.52 176.75 3hl9 h LYS 79 N 0.00 0.73 -0.32 6.66 1.57 -1.71 -0.47 116.57 123.03 3hl9 h LYS 79 Ca -0.00 -0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.80 3hl9 h LYS 79 Cb 0.60 -0.17 -0.07 0.00 0.08 0.00 0.00 32.23 32.68 3hl9 h LYS 79 CO 0.03 0.49 -0.15 1.25 -0.57 0.00 0.00 179.45 180.50 3hl9 h LEU 80 N 0.76 -0.52 -0.11 2.94 5.85 -1.82 0.41 115.31 122.82 3hl9 h LEU 80 Ca 0.45 0.12 0.04 0.00 0.84 0.00 0.00 57.88 59.34 3hl9 h LEU 80 Cb 0.53 0.29 -0.06 0.00 0.37 0.00 0.00 40.66 41.79 3hl9 h LEU 80 CO -0.30 -0.19 -0.38 -0.07 -0.34 0.00 0.00 178.44 177.15 3hl9 h LEU 81 N -0.10 -1.19 -0.50 2.25 3.38 -1.34 0.30 115.31 118.12 3hl9 h LEU 81 Ca 0.17 0.16 0.07 0.00 0.09 0.00 0.00 57.88 58.37 3hl9 h LEU 81 Cb 0.35 0.49 -0.06 0.00 0.09 0.00 0.00 40.66 41.53 3hl9 h LEU 81 CO -0.39 -0.41 0.16 0.74 0.09 0.00 0.00 178.44 178.63 3hl9 h THR 82 N -0.47 0.80 -0.67 0.22 2.02 -1.22 -0.18 112.91 113.42 3hl9 h THR 82 Ca 0.08 -0.11 0.10 0.00 0.77 0.00 0.00 66.41 67.25 3hl9 h THR 82 Cb 0.60 0.45 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 3hl9 h THR 82 CO -0.37 0.06 0.44 0.74 0.37 0.00 0.00 175.52 176.76 3hl9 h THR 83 N 0.33 0.90 0.44 3.16 2.02 0.13 -0.10 112.91 119.78 3hl9 h THR 83 Ca 0.24 -0.17 -0.02 0.00 0.77 0.00 0.00 66.41 67.23 3hl9 h THR 83 Cb 0.28 0.37 0.00 0.00 -1.74 0.00 0.00 68.15 67.06 3hl9 h THR 83 CO -0.26 0.09 -0.21 0.40 0.37 0.00 0.00 175.52 175.90 3hl9 h ILE 84 N 0.49 0.48 -0.48 3.11 2.04 0.97 -3.03 117.51 121.09 3hl9 h ILE 84 Ca 0.31 -0.45 0.14 0.00 1.00 0.00 0.00 64.86 65.86 3hl9 h ILE 84 Cb 0.56 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 37.29 3hl9 h ILE 84 CO -0.10 0.07 0.35 0.24 0.00 0.00 0.00 178.15 178.71 3hl9 h MET 85 N -0.88 0.00 -0.08 2.37 2.86 0.63 0.15 114.93 119.98 3hl9 h MET 85 Ca -0.06 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.52 3hl9 h MET 85 Cb 0.57 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.23 3hl9 h MET 85 CO 0.10 0.00 -0.20 0.00 1.06 0.00 0.00 176.91 177.86 3hl9 h ALA 86 N 1.75 0.13 0.00 6.32 0.00 -1.33 -2.79 119.26 123.34 3hl9 h ALA 86 Ca 0.23 -0.38 -0.01 0.00 0.00 0.00 0.00 54.91 54.74 3hl9 h ALA 86 Cb 0.92 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.70 3hl9 h ALA 86 CO -0.00 0.08 -0.06 -0.07 0.00 0.00 0.00 179.25 179.20 3hl9 h LEU 87 N -0.21 0.00 -0.24 0.00 3.38 -0.68 0.85 115.31 118.40 3hl9 h LEU 87 Ca -0.00 0.00 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 3hl9 h LEU 87 Cb 0.82 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.56 3hl9 h LEU 87 CO 0.04 0.06 -0.03 1.56 0.09 0.00 0.00 178.44 180.16 3hl9 h GLN 88 N 0.00 0.45 -0.35 1.13 4.20 -0.93 -1.53 115.11 118.08 3hl9 h GLN 88 Ca -0.00 -0.16 -0.07 0.00 0.06 0.00 0.00 58.65 58.48 3hl9 h GLN 88 Cb 0.40 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.13 3hl9 h GLN 88 CO 0.01 0.65 -0.08 0.00 -0.67 0.00 0.00 178.83 178.74 3hl9 h MET 90 N 0.54 0.17 0.24 0.00 1.85 -0.76 -2.10 114.93 114.87 3hl9 h MET 90 Ca 0.10 -0.02 0.01 0.00 -0.61 0.00 0.00 59.70 59.18 3hl9 h MET 90 Cb 0.46 -0.03 -0.03 0.00 0.43 0.00 0.00 31.60 32.43 3hl9 h MET 90 CO 0.02 0.21 -0.39 0.93 -0.40 0.00 0.00 176.91 177.28 3hl9 h GLU 91 N 0.08 -0.68 0.00 0.39 5.08 -1.16 -2.93 114.58 115.36 3hl9 h GLU 91 Ca 0.04 0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.45 3hl9 h GLU 91 Cb 0.09 0.15 0.00 0.00 0.50 0.00 0.00 28.75 29.50 3hl9 h GLU 91 CO -0.01 -0.45 0.00 0.54 -1.00 0.00 0.00 179.01 178.09 3hl9 n ARG 92 N -5.47 0.14 -0.00 2.33 1.74 -0.58 -4.81 116.66 110.01 3hl9 n ARG 92 Ca -0.08 0.19 0.00 0.00 -0.77 0.00 0.00 57.85 57.18 3hl9 n ARG 92 Cb 0.38 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 3hl9 n ARG 92 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3hl9 n GLY 93 N -0.54 0.36 0.26 -0.13 0.00 -0.96 -4.94 105.19 99.24 3hl9 n GLY 93 Ca 0.04 0.00 0.12 0.00 0.00 0.00 0.00 46.02 46.19 3hl9 n GLY 93 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hl9 h LEU 94 N 0.00 0.00 0.00 0.99 3.38 -1.63 -3.45 115.31 114.60 3hl9 h LEU 94 Ca 0.00 0.00 -0.22 0.00 0.09 0.00 0.00 57.88 57.75 3hl9 h LEU 94 Cb 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 40.66 40.69 3hl9 h LEU 94 CO 0.00 0.11 -0.18 1.33 0.09 0.00 0.00 178.44 179.79 3hl9 n VAL 95 N -3.71 0.00 -3.71 1.22 0.24 -1.20 -4.99 118.33 106.18 3hl9 n VAL 95 Ca -0.02 -1.20 -0.12 0.00 -2.04 0.00 0.00 64.34 60.96 3hl9 n VAL 95 Cb 0.22 0.66 -0.10 0.00 -1.47 0.00 0.00 33.84 33.15 3hl9 n VAL 95 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 3hl9 s ASP 96 N -2.28 -0.49 0.40 -1.34 2.15 -1.26 -4.61 116.67 109.24 3hl9 s ASP 96 Ca 0.20 0.90 0.16 0.00 0.43 0.00 0.00 52.55 54.23 3hl9 s ASP 96 Cb 0.00 0.85 1.03 0.00 -0.30 0.00 0.00 42.92 44.50 3hl9 s ASP 96 CO 0.14 -0.17 1.84 -0.07 -0.17 0.00 0.00 175.17 176.74 3hl9 h LEU 97 N 6.17 0.47 -1.59 -1.34 3.38 -1.96 -1.39 115.31 119.05 3hl9 h LEU 97 Ca -0.31 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.71 3hl9 h LEU 97 Cb 1.18 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 41.90 3hl9 h LEU 97 CO 0.26 0.18 -0.11 0.47 0.09 0.00 0.00 178.44 179.33 3hl9 n ASP 98 N -4.55 2.52 -4.77 -0.43 8.00 -1.26 -1.10 116.55 114.96 3hl9 n ASP 98 Ca 0.20 -1.76 -0.41 0.00 0.71 0.00 0.00 54.79 53.53 3hl9 n ASP 98 Cb 0.68 0.13 -0.01 0.00 -0.02 0.00 0.00 41.12 41.90 3hl9 n ASP 98 CO 0.00 0.00 0.00 -0.70 -0.39 0.00 0.00 177.20 176.11 3hl9 s GLU 99 N -1.88 4.22 -0.12 -1.24 2.12 -0.52 -4.87 118.70 116.40 3hl9 s GLU 99 Ca 0.22 2.41 -0.29 0.00 0.36 0.00 0.00 54.97 57.67 3hl9 s GLU 99 Cb 0.17 -3.03 -0.04 0.00 0.26 0.00 0.00 34.13 31.49 3hl9 s GLU 99 CO 0.33 -0.41 1.63 0.99 -0.54 0.00 0.00 175.26 177.25 3hl9 s THR 100 N -0.84 3.66 0.28 -1.70 2.01 -1.26 -4.03 115.64 113.75 3hl9 s THR 100 Ca 0.53 0.78 0.12 0.00 0.31 0.00 0.00 61.69 63.43 3hl9 s THR 100 Cb -0.44 -3.56 0.29 0.00 0.01 0.00 0.00 72.50 68.80 3hl9 s THR 100 CO 0.55 -0.14 1.24 0.55 -0.69 0.00 0.00 174.62 176.13 3hl9 n VAL 101 N 5.82 -0.33 0.28 3.82 3.14 0.16 -2.68 118.33 128.53 3hl9 n VAL 101 Ca 0.18 1.64 0.10 0.00 -2.96 0.00 0.00 64.34 63.29 3hl9 n VAL 101 Cb 0.44 -2.57 0.54 0.00 -1.06 0.00 0.00 33.84 31.19 3hl9 n VAL 101 CO 0.00 0.00 0.00 -2.24 -6.46 0.00 0.00 176.83 168.13 3hl9 h ASP 102 N 0.00 0.00 0.46 6.55 3.04 -1.81 0.27 116.42 124.93 3hl9 h ASP 102 Ca 0.61 0.00 -0.02 0.00 -3.24 0.00 0.00 57.03 54.38 3hl9 h ASP 102 Cb 1.52 0.00 -0.00 0.00 -1.04 0.00 0.00 39.33 39.81 3hl9 h ASP 102 CO -0.65 0.00 -0.25 -0.09 -2.04 0.00 0.00 179.24 176.21 3hl9 h ARG 103 N 0.00 -0.63 0.00 4.15 2.43 -1.92 -2.92 114.38 115.49 3hl9 h ARG 103 Ca 0.00 0.04 -0.21 0.00 -0.81 0.00 0.00 59.98 59.00 3hl9 h ARG 103 Cb 0.85 0.14 -0.04 0.00 -0.42 0.00 0.00 29.97 30.51 3hl9 h ARG 103 CO 0.00 -0.42 -1.47 -0.07 -1.51 0.00 0.00 179.97 176.49 3hl9 h LEU 104 N -0.66 0.00 -5.92 3.80 -0.00 -0.89 -3.41 115.31 108.23 3hl9 h LEU 104 Ca -0.06 0.00 -0.57 0.00 -0.00 0.00 0.00 57.88 57.26 3hl9 h LEU 104 Cb 0.52 0.00 -0.41 0.00 -0.00 0.00 0.00 40.66 40.77 3hl9 h LEU 104 CO 0.08 0.74 -0.84 0.18 -0.00 0.00 0.00 178.44 178.60 3hl9 n LEU 105 N -2.97 2.46 -0.27 1.67 4.77 0.59 -4.90 117.00 118.35 3hl9 n LEU 105 Ca -0.12 -5.22 -0.06 0.00 -0.03 0.00 0.00 56.01 50.58 3hl9 n LEU 105 Cb 0.92 -0.06 0.05 0.00 -2.33 0.00 0.00 43.42 42.00 3hl9 n LEU 105 CO 0.44 2.16 1.03 -0.65 -1.33 0.00 0.00 177.39 179.04 3hl9 h PRO 106 N 3.68 1.10 -0.43 3.23 0.11 -1.74 -1.87 132.00 136.08 3hl9 h PRO 106 Ca 0.13 -0.20 0.08 0.00 0.11 0.00 0.00 66.00 66.13 3hl9 h PRO 106 Cb 0.74 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.65 3hl9 h PRO 106 CO 0.68 0.90 0.30 0.38 -0.21 0.00 0.00 178.00 180.05 3hl9 h ASP 107 N 1.06 0.20 -0.03 -2.05 2.03 -1.91 0.37 116.42 116.09 3hl9 h ASP 107 Ca 0.25 0.00 -0.20 0.00 -0.73 0.00 0.00 57.03 56.35 3hl9 h ASP 107 Cb 0.21 -0.04 0.01 0.00 -0.83 0.00 0.00 39.33 38.69 3hl9 h ASP 107 CO -0.02 0.12 -0.77 0.25 -1.03 0.00 0.00 179.24 177.80 3hl9 h LEU 108 N 0.22 0.73 -1.41 0.15 5.85 -1.77 -3.05 115.31 116.02 3hl9 h LEU 108 Ca 0.20 -0.72 -0.01 0.00 0.84 0.00 0.00 57.88 58.18 3hl9 h LEU 108 Cb 0.49 -0.22 -0.00 0.00 0.37 0.00 0.00 40.66 41.30 3hl9 h LEU 108 CO -0.04 1.35 -0.06 -1.28 -0.34 0.00 0.00 178.44 178.08 3hl9 h SER 109 N 0.18 0.00 0.26 1.25 0.87 -0.59 -2.17 113.55 113.35 3hl9 h SER 109 Ca -0.09 0.00 -0.16 0.00 -1.23 0.00 0.00 61.79 60.32 3hl9 h SER 109 Cb 1.44 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 63.39 3hl9 h SER 109 CO 0.15 0.06 -0.61 0.00 -0.53 0.00 0.00 176.83 175.90 3hl9 h ALA 110 N 1.94 0.77 -1.90 6.23 0.00 -0.31 -3.46 119.26 122.53 3hl9 h ALA 110 Ca -0.00 -0.55 -0.63 0.00 0.00 0.00 0.00 54.91 53.74 3hl9 h ALA 110 Cb 0.56 -0.08 0.09 0.00 0.00 0.00 0.00 17.79 18.35 3hl9 h ALA 110 CO 0.01 0.72 0.29 -1.33 0.00 0.00 0.00 179.25 178.94 3hl9 n MET 111 N -3.89 1.35 -2.16 0.00 2.00 -0.82 -4.99 117.12 108.61 3hl9 n MET 111 Ca -0.03 0.48 -0.27 0.00 0.00 0.00 0.00 57.70 57.88 3hl9 n MET 111 Cb 0.63 -1.97 0.11 0.00 0.00 0.00 0.00 33.22 31.99 3hl9 n MET 111 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 175.97 174.72 3hl9 s PRO 112 N -0.67 1.67 -0.17 0.03 0.04 -1.26 -4.76 135.00 129.87 3hl9 s PRO 112 Ca 0.69 -0.40 -0.07 0.00 0.04 0.00 0.00 61.00 61.25 3hl9 s PRO 112 Cb -0.78 -2.09 -0.04 0.00 0.04 0.00 0.00 34.50 31.63 3hl9 s PRO 112 CO 0.54 -1.63 0.08 0.54 0.04 0.00 0.00 177.00 176.57 3hl9 s VAL 113 N -3.44 4.94 -0.35 -0.36 0.11 0.27 -2.23 120.40 119.34 3hl9 s VAL 113 Ca 0.65 0.02 -0.27 0.00 -2.93 0.00 0.00 61.98 59.45 3hl9 s VAL 113 Cb -0.08 -3.22 0.02 0.00 -1.53 0.00 0.00 36.38 31.57 3hl9 s VAL 113 CO 0.47 0.48 0.99 -0.22 -3.33 0.00 0.00 175.10 173.49 3hl9 s LEU 114 N 0.15 3.95 -0.12 2.54 0.20 0.20 -1.61 118.68 123.99 3hl9 s LEU 114 Ca 0.06 0.75 -0.22 0.00 0.69 0.00 0.00 54.13 55.40 3hl9 s LEU 114 Cb -0.12 -3.37 -0.27 0.00 -0.43 0.00 0.00 46.19 42.00 3hl9 s LEU 114 CO 0.00 -0.88 0.66 -0.08 -0.29 0.00 0.00 176.35 175.76 3hl9 h GLU 115 N 8.37 0.15 0.00 1.98 4.81 -1.80 -3.43 114.58 124.66 3hl9 h GLU 115 Ca -0.22 -0.25 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 3hl9 h GLU 115 Cb 1.07 0.09 0.00 0.00 0.63 0.00 0.00 28.75 30.55 3hl9 h GLU 115 CO 1.00 1.12 0.00 0.41 -0.73 0.00 0.00 179.01 180.81 3hl9 n GLY 116 N 1.63 -0.93 3.40 1.92 0.00 -1.20 -5.08 105.19 104.92 3hl9 n GLY 116 Ca -0.19 -0.72 -0.26 0.00 0.00 0.00 0.00 46.02 44.85 3hl9 n GLY 116 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3hl9 s PHE 117 N -3.00 2.18 0.00 1.61 0.40 -1.26 -1.38 117.98 116.53 3hl9 s PHE 117 Ca 0.00 -0.38 0.00 0.00 -0.60 0.00 0.00 56.93 55.95 3hl9 s PHE 117 Cb 0.00 -1.10 0.00 0.00 0.51 0.00 0.00 43.02 42.43 3hl9 s PHE 117 CO 0.00 0.44 0.00 -0.40 0.70 0.00 0.00 175.22 175.96 3hl9 n ASP 118 N 0.36 0.00 0.01 1.36 5.75 -1.00 -4.90 116.55 118.13 3hl9 n ASP 118 Ca -0.13 -0.07 -0.22 0.00 -0.01 0.00 0.00 54.79 54.36 3hl9 n ASP 118 Cb 0.56 0.00 -0.14 0.00 -1.03 0.00 0.00 41.12 40.51 3hl9 n ASP 118 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 3hl9 h ASP 119 N 0.00 0.42 0.06 -1.12 3.32 -2.02 -3.11 116.42 113.98 3hl9 h ASP 119 Ca 0.00 -0.94 0.00 0.00 0.02 0.00 0.00 57.03 56.11 3hl9 h ASP 119 Cb 0.00 -0.14 0.00 0.00 0.22 0.00 0.00 39.33 39.41 3hl9 h ASP 119 CO 0.00 1.84 0.00 0.00 -1.72 0.00 0.00 179.24 179.36 3hl9 n ALA 120 N -3.00 1.09 0.00 3.45 0.00 -1.26 -4.85 120.51 115.94 3hl9 n ALA 120 Ca -0.31 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.25 3hl9 n ALA 120 Cb 1.03 -1.22 0.00 0.00 0.00 0.00 0.00 19.45 19.26 3hl9 n ALA 120 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hl9 n GLY 121 N -1.23 0.80 3.53 0.00 0.00 -1.17 -5.03 105.19 102.08 3hl9 n GLY 121 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.61 3hl9 n GLY 121 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3hl9 n ASN 122 N 0.00 0.03 -4.66 1.61 3.02 -1.26 -4.44 115.26 109.56 3hl9 n ASN 122 Ca 0.00 0.91 -0.42 0.00 -0.03 0.00 0.00 54.58 55.04 3hl9 n ASN 122 Cb 0.00 -1.24 -0.03 0.00 -0.61 0.00 0.00 39.78 37.90 3hl9 n ASN 122 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 3hl9 s ALA 123 N -1.45 3.56 -0.20 5.41 0.00 -1.26 -2.37 121.76 125.45 3hl9 s ALA 123 Ca 0.66 1.29 -0.14 0.00 0.00 0.00 0.00 51.96 53.77 3hl9 s ALA 123 Cb -0.54 -3.85 -0.04 0.00 0.00 0.00 0.00 23.12 18.69 3hl9 s ALA 123 CO 0.56 -1.60 0.32 0.50 0.00 0.00 0.00 175.76 175.53 3hl9 s ARG 124 N 4.50 4.17 0.04 0.00 3.52 -0.48 -4.93 118.95 125.77 3hl9 s ARG 124 Ca 0.88 0.06 0.04 0.00 -0.13 0.00 0.00 55.73 56.58 3hl9 s ARG 124 Cb -0.42 -3.51 -0.02 0.00 -1.56 0.00 0.00 34.95 29.44 3hl9 s ARG 124 CO 0.41 0.05 -0.12 -1.17 -0.81 0.00 0.00 175.30 173.66 3hl9 s LEU 125 N 1.06 2.20 0.02 -0.88 2.96 -1.26 -2.47 118.68 120.30 3hl9 s LEU 125 Ca 0.16 -0.48 -0.06 0.00 -0.22 0.00 0.00 54.13 53.53 3hl9 s LEU 125 Cb -0.14 -0.44 -0.01 0.00 0.50 0.00 0.00 46.19 46.10 3hl9 s LEU 125 CO 0.06 -0.04 0.10 -0.60 -1.32 0.00 0.00 176.35 174.54 3hl9 s ARG 126 N -1.27 0.49 0.64 1.98 3.52 -0.63 -4.90 118.95 118.78 3hl9 s ARG 126 Ca -0.02 -0.54 -0.11 0.00 -0.13 0.00 0.00 55.73 54.93 3hl9 s ARG 126 Cb -0.08 0.19 -0.03 0.00 -1.56 0.00 0.00 34.95 33.48 3hl9 s ARG 126 CO 0.01 -0.11 1.04 -1.83 -0.81 0.00 0.00 175.30 173.60 3hl9 s GLU 127 N -1.77 3.42 -0.21 5.12 -1.05 -1.26 -0.57 118.70 122.38 3hl9 s GLU 127 Ca -0.12 0.70 -0.27 0.00 -0.15 0.00 0.00 54.97 55.13 3hl9 s GLU 127 Cb -0.06 -2.06 -0.00 0.00 -0.44 0.00 0.00 34.13 31.56 3hl9 s GLU 127 CO -0.01 -0.69 0.93 0.50 0.95 0.00 0.00 175.26 176.95 3hl9 s ARG 128 N -5.21 4.25 0.04 -4.83 3.52 -1.26 -4.74 118.95 110.72 3hl9 s ARG 128 Ca 0.56 1.16 -0.30 0.00 -0.13 0.00 0.00 55.73 57.02 3hl9 s ARG 128 Cb -0.11 -3.62 -0.05 0.00 -1.56 0.00 0.00 34.95 29.61 3hl9 s ARG 128 CO 0.54 -0.52 1.10 1.03 -0.81 0.00 0.00 175.30 176.63 3hl9 s ARG 129 N 2.82 4.50 0.00 5.12 0.52 -1.26 -4.80 118.95 125.84 3hl9 s ARG 129 Ca 0.40 1.61 0.00 0.00 -0.52 0.00 0.00 55.73 57.23 3hl9 s ARG 129 Cb -0.16 -3.39 0.00 0.00 0.52 0.00 0.00 34.95 31.92 3hl9 s ARG 129 CO 0.08 -0.14 0.00 0.41 0.02 0.00 0.00 175.30 175.67 3hl9 n GLY 130 N 3.00 -0.02 3.21 -3.53 0.00 -1.26 -4.36 105.19 102.23 3hl9 n GLY 130 Ca 0.07 -1.92 -0.13 0.00 0.00 0.00 0.00 46.02 44.05 3hl9 n GLY 130 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3hl9 s LYS 131 N -1.22 1.25 -0.07 1.61 -0.14 -1.26 -4.95 119.74 114.97 3hl9 s LYS 131 Ca 0.00 -1.67 0.01 0.00 -1.36 0.00 0.00 55.97 52.96 3hl9 s LYS 131 Cb 0.00 0.26 0.02 0.00 -1.68 0.00 0.00 37.83 36.43 3hl9 s LYS 131 CO 0.00 -0.41 -0.08 -1.50 -0.76 0.00 0.00 175.35 172.60 3hl9 s ILE 132 N -4.09 0.89 0.31 2.17 2.07 -1.26 -4.78 121.20 116.51 3hl9 s ILE 132 Ca 0.39 -0.30 0.08 0.00 -1.41 0.00 0.00 60.65 59.41 3hl9 s ILE 132 Cb 0.07 -0.86 -0.06 0.00 0.13 0.00 0.00 42.46 41.73 3hl9 s ILE 132 CO 0.13 0.31 -0.06 0.42 -1.91 0.00 0.00 174.94 173.83 3hl9 s THR 133 N 0.99 1.85 0.34 4.00 -4.23 -1.26 -0.67 115.64 116.67 3hl9 s THR 133 Ca -0.09 -2.14 0.02 0.00 -1.18 0.00 0.00 61.69 58.30 3hl9 s THR 133 Cb -0.15 -2.56 0.23 0.00 1.34 0.00 0.00 72.50 71.37 3hl9 s THR 133 CO 0.00 -0.24 1.97 0.25 -0.54 0.00 0.00 174.62 176.06 3hl9 h LEU 134 N 2.16 0.68 -0.77 4.79 7.12 -1.56 -0.52 115.31 127.20 3hl9 h LEU 134 Ca -0.41 -0.05 0.02 0.00 0.13 0.00 0.00 57.88 57.57 3hl9 h LEU 134 Cb 1.24 -0.17 -0.04 0.00 -0.53 0.00 0.00 40.66 41.16 3hl9 h LEU 134 CO 0.69 0.55 0.51 -0.09 -0.13 0.00 0.00 178.44 179.96 3hl9 h ARG 135 N 0.77 0.99 -0.62 1.25 2.43 -1.45 -1.69 114.38 116.06 3hl9 h ARG 135 Ca 0.20 -0.06 -0.00 0.00 -0.81 0.00 0.00 59.98 59.31 3hl9 h ARG 135 Cb 0.02 -0.22 -0.03 0.00 -0.42 0.00 0.00 29.97 29.32 3hl9 h ARG 135 CO -0.03 0.66 0.38 0.45 -1.51 0.00 0.00 179.97 179.91 3hl9 h HIS 136 N 1.02 0.82 0.29 2.20 3.86 -1.39 -2.44 115.15 119.51 3hl9 h HIS 136 Ca 0.29 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.49 3hl9 h HIS 136 Cb -0.08 -0.27 -0.01 0.00 1.06 0.00 0.00 27.41 28.11 3hl9 h HIS 136 CO -0.02 0.56 -0.18 -0.07 0.86 0.00 0.00 177.93 179.07 3hl9 h LEU 137 N 0.85 -0.46 -1.92 2.43 3.38 -0.94 -0.21 115.31 118.44 3hl9 h LEU 137 Ca 0.22 0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.22 3hl9 h LEU 137 Cb -0.02 0.14 0.00 0.00 0.09 0.00 0.00 40.66 40.87 3hl9 h LEU 137 CO -0.04 -0.29 0.00 -0.07 0.09 0.00 0.00 178.44 178.12 3hl9 h LEU 138 N -0.46 0.00 -2.75 1.67 3.38 -1.15 -2.00 115.31 114.01 3hl9 h LEU 138 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 3hl9 h LEU 138 Cb 0.38 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.13 3hl9 h LEU 138 CO 0.02 0.00 0.00 0.35 0.09 0.00 0.00 178.44 178.90 3hl9 n THR 139 N -2.81 0.92 -3.22 0.22 -2.24 -0.93 -4.02 114.28 102.20 3hl9 n THR 139 Ca -0.01 -0.96 -0.23 0.00 -2.27 0.00 0.00 64.05 60.58 3hl9 n THR 139 Cb 0.16 0.56 0.03 0.00 -2.10 0.00 0.00 70.33 68.98 3hl9 n THR 139 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 3hl9 n HIS 140 N 0.86 -2.04 -1.14 4.78 8.25 -0.75 -4.85 115.22 120.33 3hl9 n HIS 140 Ca 0.15 0.58 0.09 0.00 -0.26 0.00 0.00 57.72 58.28 3hl9 n HIS 140 Cb 0.48 -4.13 0.13 0.00 1.12 0.00 0.00 29.99 27.60 3hl9 n HIS 140 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 3hl9 n THR 141 N -4.43 1.80 0.40 1.59 -1.04 -0.12 -1.38 114.28 111.09 3hl9 n THR 141 Ca -0.07 -2.18 0.10 0.00 -2.04 0.00 0.00 64.05 59.86 3hl9 n THR 141 Cb 0.59 -0.20 0.41 0.00 -1.82 0.00 0.00 70.33 69.31 3hl9 n THR 141 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 3hl9 n SER 142 N -1.35 0.40 0.00 8.00 3.41 -1.13 -1.47 113.62 121.47 3hl9 n SER 142 Ca 0.15 0.61 0.00 0.00 -0.26 0.00 0.00 58.87 59.37 3hl9 n SER 142 Cb 0.65 -0.69 0.00 0.00 -0.26 0.00 0.00 64.21 63.91 3hl9 n SER 142 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3hl9 n GLY 143 N -0.17 0.45 3.45 5.00 0.00 -1.26 -3.77 105.19 108.90 3hl9 n GLY 143 Ca 0.02 -0.52 -0.25 0.00 0.00 0.00 0.00 46.02 45.28 3hl9 n GLY 143 CO 0.00 0.00 0.00 0.48 0.00 0.00 0.00 173.32 173.80 3hl9 s LEU 144 N 0.00 2.54 0.28 0.99 0.05 -1.26 -1.54 118.68 119.74 3hl9 s LEU 144 Ca 0.00 -0.98 0.02 0.00 0.05 0.00 0.00 54.13 53.22 3hl9 s LEU 144 Cb 0.00 -1.11 -0.04 0.00 -2.05 0.00 0.00 46.19 42.99 3hl9 s LEU 144 CO 0.00 0.06 0.14 -0.55 -0.55 0.00 0.00 176.35 175.45 3hl9 s SER 145 N -3.25 1.30 0.24 1.48 0.15 -1.26 -4.34 113.70 108.01 3hl9 s SER 145 Ca 0.27 -1.49 -0.15 0.00 0.70 0.00 0.00 55.95 55.28 3hl9 s SER 145 Cb -0.06 0.32 -0.08 0.00 -1.71 0.00 0.00 66.02 64.49 3hl9 s SER 145 CO 0.13 -0.84 0.66 -0.31 1.20 0.00 0.00 173.24 174.08 3hl9 s TYR 146 N -3.70 3.50 0.07 3.44 2.02 -1.20 -4.10 117.35 117.36 3hl9 s TYR 146 Ca 0.37 1.15 -0.29 0.00 -0.37 0.00 0.00 57.07 57.93 3hl9 s TYR 146 Cb 0.06 -2.46 -0.18 0.00 -0.40 0.00 0.00 41.96 38.98 3hl9 s TYR 146 CO 0.16 0.26 1.63 0.28 -1.57 0.00 0.00 175.55 176.30 3hl9 h VAL 147 N 2.32 0.56 -0.11 0.71 2.07 -1.95 -3.04 116.25 116.81 3hl9 h VAL 147 Ca -0.48 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 66.99 3hl9 h VAL 147 Cb 1.18 0.58 0.00 0.00 -1.52 0.00 0.00 31.29 31.54 3hl9 h VAL 147 CO 0.66 0.01 0.00 0.49 0.02 0.00 0.00 177.57 178.75 3hl9 n PHE 148 N -5.34 0.31 -0.03 1.57 3.72 -1.26 -3.11 117.46 113.32 3hl9 n PHE 148 Ca -0.11 -0.12 0.01 0.00 -0.05 0.00 0.00 57.45 57.17 3hl9 n PHE 148 Cb 0.26 -0.12 -0.09 0.00 -0.94 0.00 0.00 39.48 38.59 3hl9 n PHE 148 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 3hl9 n LEU 149 N 0.04 0.00 -4.53 4.37 4.77 -1.15 -5.00 117.00 115.50 3hl9 n LEU 149 Ca 0.05 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.69 3hl9 n LEU 149 Cb 0.32 0.13 -0.12 0.00 -2.33 0.00 0.00 43.42 41.42 3hl9 n LEU 149 CO 0.05 0.13 -0.37 -2.28 -1.33 0.00 0.00 177.39 173.59 3hl9 s HIS 150 N -2.55 2.98 0.47 -1.77 2.46 -1.18 -5.01 115.29 110.68 3hl9 s HIS 150 Ca -0.05 -0.17 0.13 0.00 0.47 0.00 0.00 55.06 55.44 3hl9 s HIS 150 Cb 0.05 -1.84 1.09 0.00 -0.13 0.00 0.00 32.58 31.75 3hl9 s HIS 150 CO 0.47 0.12 2.07 -1.35 -2.47 0.00 0.00 174.74 173.59 3hl9 h PRO 151 N 6.03 0.11 0.25 2.88 0.11 -1.94 -0.94 132.00 138.50 3hl9 h PRO 151 Ca -0.39 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.70 3hl9 h PRO 151 Cb 1.19 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.28 3hl9 h PRO 151 CO 0.57 0.14 -0.12 -0.07 -0.21 0.00 0.00 178.00 178.31 3hl9 h LEU 152 N 0.11 -0.29 -0.98 2.35 3.38 -1.95 -3.04 115.31 114.89 3hl9 h LEU 152 Ca 0.03 -0.22 0.14 0.00 0.09 0.00 0.00 57.88 57.91 3hl9 h LEU 152 Cb 0.11 0.07 -0.09 0.00 0.09 0.00 0.00 40.66 40.84 3hl9 h LEU 152 CO 0.00 0.21 0.61 -0.07 0.09 0.00 0.00 178.44 179.27 3hl9 h LEU 153 N -0.93 0.85 -0.87 1.67 3.38 -1.78 -0.12 115.31 117.51 3hl9 h LEU 153 Ca -0.03 0.06 0.14 0.00 0.09 0.00 0.00 57.88 58.14 3hl9 h LEU 153 Cb 0.49 -0.10 -0.15 0.00 0.09 0.00 0.00 40.66 41.00 3hl9 h LEU 153 CO 0.06 0.41 -0.37 0.03 0.09 0.00 0.00 178.44 178.66 3hl9 h ARG 154 N 0.90 -0.05 0.08 1.13 2.47 -1.14 0.40 114.38 118.17 3hl9 h ARG 154 Ca 0.51 0.00 -0.26 0.00 -1.26 0.00 0.00 59.98 58.98 3hl9 h ARG 154 Cb 0.60 0.01 0.01 0.00 -1.65 0.00 0.00 29.97 28.94 3hl9 h ARG 154 CO -0.30 -0.03 -1.11 1.49 0.56 0.00 0.00 179.97 180.57 3hl9 h GLU 155 N -0.05 0.37 -0.76 0.04 4.81 -0.98 -0.32 114.58 117.70 3hl9 h GLU 155 Ca 0.31 -0.50 0.15 0.00 -0.13 0.00 0.00 59.36 59.20 3hl9 h GLU 155 Cb 0.59 0.17 -0.10 0.00 0.63 0.00 0.00 28.75 30.03 3hl9 h GLU 155 CO -0.89 1.19 0.27 -0.92 -0.73 0.00 0.00 179.01 177.93 3hl9 h TYR 156 N 0.16 0.46 -0.36 0.92 3.20 -0.26 0.50 116.97 121.59 3hl9 h TYR 156 Ca -0.12 0.04 -0.03 0.00 3.14 0.00 0.00 58.73 61.76 3hl9 h TYR 156 Cb 1.79 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 39.96 3hl9 h TYR 156 CO 0.07 0.02 0.09 1.98 -1.64 0.00 0.00 178.16 178.68 3hl9 h MET 157 N 0.39 0.57 -0.43 1.82 4.05 -0.10 -2.28 114.93 118.94 3hl9 h MET 157 Ca 0.42 -0.13 0.08 0.00 -0.28 0.00 0.00 59.70 59.79 3hl9 h MET 157 Cb 0.67 -0.08 -0.07 0.00 -0.80 0.00 0.00 31.60 31.33 3hl9 h MET 157 CO -0.44 0.61 0.04 0.00 0.23 0.00 0.00 176.91 177.35 3hl9 h ALA 158 N 0.93 0.44 -0.62 0.39 0.00 0.90 -2.18 119.26 119.13 3hl9 h ALA 158 Ca 0.11 0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 3hl9 h ALA 158 Cb 0.29 0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 3hl9 h ALA 158 CO 0.00 -0.36 0.21 1.96 0.00 0.00 0.00 179.25 181.06 3hl9 h GLN 159 N 0.16 0.92 -0.13 0.00 1.08 0.01 -3.47 115.11 113.68 3hl9 h GLN 159 Ca 0.22 -0.17 0.00 0.00 -1.45 0.00 0.00 58.65 57.25 3hl9 h GLN 159 Cb 0.29 -0.15 0.00 0.00 -0.05 0.00 0.00 27.48 27.57 3hl9 h GLN 159 CO -0.32 0.78 0.00 0.41 -0.95 0.00 0.00 178.83 178.75 3hl9 n GLY 160 N -0.92 1.12 0.01 3.46 0.00 -0.82 -5.00 105.19 103.05 3hl9 n GLY 160 Ca 0.05 -0.12 0.13 0.00 0.00 0.00 0.00 46.02 46.09 3hl9 n GLY 160 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 3hl9 n HIS 161 N -0.59 0.12 0.91 1.61 8.25 -1.00 -3.31 115.22 121.20 3hl9 n HIS 161 Ca 0.00 0.03 0.13 0.00 -0.26 0.00 0.00 57.72 57.62 3hl9 n HIS 161 Cb 0.08 -0.51 0.34 0.00 1.12 0.00 0.00 29.99 31.02 3hl9 n HIS 161 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 3hl9 n LEU 162 N -1.60 0.42 -0.23 2.41 4.77 -1.26 -4.04 117.00 117.47 3hl9 n LEU 162 Ca 0.06 0.20 -0.01 0.00 -0.03 0.00 0.00 56.01 56.23 3hl9 n LEU 162 Cb 0.35 -0.31 0.20 0.00 -2.33 0.00 0.00 43.42 41.33 3hl9 n LEU 162 CO 0.29 0.05 1.18 1.56 -1.33 0.00 0.00 177.39 179.14 3hl9 h GLN 163 N 0.00 1.04 0.00 3.23 4.20 -1.95 -3.19 115.11 118.44 3hl9 h GLN 163 Ca 0.00 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.61 3hl9 h GLN 163 Cb 0.55 -0.21 0.00 0.00 0.30 0.00 0.00 27.48 28.12 3hl9 h GLN 163 CO 0.00 0.74 0.00 0.77 -0.67 0.00 0.00 178.83 179.67 3hl9 h SER 164 N 1.05 0.00 -0.96 1.46 0.02 -1.81 -3.19 113.55 110.12 3hl9 h SER 164 Ca 0.27 0.00 0.19 0.00 -0.84 0.00 0.00 61.79 61.41 3hl9 h SER 164 Cb -0.02 0.00 -0.09 0.00 0.14 0.00 0.00 62.40 62.44 3hl9 h SER 164 CO -0.05 0.00 0.61 0.00 -1.14 0.00 0.00 176.83 176.25 3hl9 h ALA 165 N 2.14 1.92 -0.95 3.77 0.00 -1.83 -1.71 119.26 122.59 3hl9 h ALA 165 Ca 0.00 0.04 0.25 0.00 0.00 0.00 0.00 54.91 55.20 3hl9 h ALA 165 Cb 0.37 -0.07 -0.13 0.00 0.00 0.00 0.00 17.79 17.96 3hl9 h ALA 165 CO 0.00 -0.24 0.48 0.93 0.00 0.00 0.00 179.25 180.42 3hl9 h GLU 166 N 0.62 0.41 -0.40 0.00 5.08 -1.76 -1.02 114.58 117.51 3hl9 h GLU 166 Ca 0.52 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.85 3hl9 h GLU 166 Cb 1.00 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 30.13 3hl9 h GLU 166 CO -0.27 0.27 0.21 0.87 -1.00 0.00 0.00 179.01 179.09 3hl9 h LYS 167 N 0.43 0.54 -0.47 2.33 1.57 -1.58 -2.36 116.57 117.03 3hl9 h LYS 167 Ca 0.62 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 59.35 3hl9 h LYS 167 Cb 1.24 -0.11 0.00 0.00 0.08 0.00 0.00 32.23 33.44 3hl9 h LYS 167 CO -0.54 0.41 0.00 1.19 -0.57 0.00 0.00 179.45 179.94 3hl9 n PHE 168 N -4.42 1.20 -2.40 -1.35 3.72 -0.45 -4.95 117.46 108.82 3hl9 n PHE 168 Ca 0.03 -0.68 -0.19 0.00 -0.05 0.00 0.00 57.45 56.56 3hl9 n PHE 168 Cb 0.11 -0.25 -0.01 0.00 -0.94 0.00 0.00 39.48 38.38 3hl9 n PHE 168 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3hl9 n GLY 169 N 0.49 -0.47 3.71 1.37 0.00 -0.89 -4.96 105.19 104.45 3hl9 n GLY 169 Ca 0.22 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.84 3hl9 n GLY 169 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hl9 s ILE 170 N -2.97 5.05 0.36 -0.61 1.01 -0.83 -5.01 121.20 118.20 3hl9 s ILE 170 Ca 0.00 1.38 -0.28 0.00 0.00 0.00 0.00 60.65 61.75 3hl9 s ILE 170 Cb 0.00 -4.02 -0.11 0.00 0.01 0.00 0.00 42.46 38.35 3hl9 s ILE 170 CO 0.00 0.23 1.48 -1.10 0.00 0.00 0.00 174.94 175.54 3hl9 s GLN 171 N 1.00 4.15 0.22 2.79 -1.52 -1.26 -4.40 119.66 120.64 3hl9 s GLN 171 Ca 0.35 2.52 -0.10 0.00 -1.95 0.00 0.00 55.36 56.18 3hl9 s GLN 171 Cb -0.17 -2.99 0.33 0.00 -0.22 0.00 0.00 33.01 29.95 3hl9 s GLN 171 CO 0.16 -0.50 1.64 1.03 -0.25 0.00 0.00 175.29 177.37 3hl9 h SER 172 N 3.36 -0.41 0.94 5.90 0.87 -1.97 -1.45 113.55 120.79 3hl9 h SER 172 Ca -0.50 0.18 -0.04 0.00 -1.23 0.00 0.00 61.79 60.20 3hl9 h SER 172 Cb 1.23 0.34 -0.01 0.00 -0.44 0.00 0.00 62.40 63.53 3hl9 h SER 172 CO 0.67 -0.17 -0.20 -0.09 -0.53 0.00 0.00 176.83 176.50 3hl9 h ARG 173 N 0.07 0.00 0.00 2.24 2.43 -2.02 -2.67 114.38 114.43 3hl9 h ARG 173 Ca 0.35 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.52 3hl9 h ARG 173 Cb 0.57 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 3hl9 h ARG 173 CO -0.62 0.20 -0.53 1.28 -1.51 0.00 0.00 179.97 178.79 3hl9 n LEU 174 N -3.37 0.55 -0.24 3.80 4.32 -0.60 -4.53 117.00 116.93 3hl9 n LEU 174 Ca 0.00 0.12 -0.08 0.00 -0.02 0.00 0.00 56.01 56.03 3hl9 n LEU 174 Cb 0.42 -0.24 0.04 0.00 -1.62 0.00 0.00 43.42 42.02 3hl9 n LEU 174 CO 0.33 0.05 0.93 0.00 -1.22 0.00 0.00 177.39 177.47 3hl9 h ALA 175 N 2.80 0.88 -2.86 -1.18 0.00 -1.04 -3.46 119.26 114.40 3hl9 h ALA 175 Ca 0.00 -0.24 -0.53 0.00 0.00 0.00 0.00 54.91 54.14 3hl9 h ALA 175 Cb 0.60 -0.26 0.10 0.00 0.00 0.00 0.00 17.79 18.23 3hl9 h ALA 175 CO 0.00 0.61 0.56 -1.25 0.00 0.00 0.00 179.25 179.16 3hl9 s PRO 176 N -5.30 3.56 0.78 0.00 0.04 -1.26 -4.99 135.00 127.82 3hl9 s PRO 176 Ca -0.12 2.03 -0.11 0.00 0.04 0.00 0.00 61.00 62.84 3hl9 s PRO 176 Cb 0.14 -2.42 0.06 0.00 0.04 0.00 0.00 34.50 32.32 3hl9 s PRO 176 CO 0.84 -0.79 1.08 -2.14 0.04 0.00 0.00 177.00 176.03 3hl9 s PRO 177 N -2.69 2.23 0.77 0.56 0.02 -1.26 -5.01 135.00 129.61 3hl9 s PRO 177 Ca 0.65 0.85 -0.11 0.00 0.02 0.00 0.00 61.00 62.42 3hl9 s PRO 177 Cb -0.35 -1.92 0.05 0.00 0.02 0.00 0.00 34.50 32.30 3hl9 s PRO 177 CO 0.43 -1.57 1.09 0.00 -0.33 0.00 0.00 177.00 176.61 3hl9 s ALA 178 N -3.05 2.29 -0.13 -1.55 0.00 -0.95 -4.69 121.76 113.69 3hl9 s ALA 178 Ca 0.60 0.21 0.03 0.00 0.00 0.00 0.00 51.96 52.81 3hl9 s ALA 178 Cb -0.15 -3.25 0.07 0.00 0.00 0.00 0.00 23.12 19.79 3hl9 s ALA 178 CO 0.55 -1.71 1.05 1.33 0.00 0.00 0.00 175.76 176.99 3hl9 n VAL 179 N -3.48 1.11 -3.90 0.00 0.24 -0.96 0.61 118.33 111.95 3hl9 n VAL 179 Ca 0.09 -1.14 -0.02 0.00 -2.04 0.00 0.00 64.34 61.23 3hl9 n VAL 179 Cb 0.53 0.42 0.02 0.00 -1.47 0.00 0.00 33.84 33.33 3hl9 n VAL 179 CO 0.00 0.00 0.00 0.21 -2.14 0.00 0.00 176.83 174.90 3hl9 s ASN 180 N -1.20 0.00 0.44 -1.34 3.84 -0.59 -4.86 114.94 111.24 3hl9 s ASN 180 Ca 0.07 -0.55 -0.07 0.00 0.21 0.00 0.00 52.86 52.52 3hl9 s ASN 180 Cb 0.05 0.41 -0.05 0.00 -0.55 0.00 0.00 41.25 41.11 3hl9 s ASN 180 CO 0.02 -0.81 0.76 -1.81 -2.79 0.00 0.00 177.10 172.48 3hl9 s ASP 181 N -3.49 6.37 0.49 -4.21 1.01 -1.26 -4.64 116.67 110.93 3hl9 s ASP 181 Ca 0.23 0.99 -0.24 0.00 0.71 0.00 0.00 52.55 54.25 3hl9 s ASP 181 Cb -0.02 -2.27 -0.07 0.00 1.01 0.00 0.00 42.92 41.57 3hl9 s ASP 181 CO 0.04 -0.49 1.36 -2.84 0.21 0.00 0.00 175.17 173.45 3hl9 s PRO 182 N -4.33 3.50 0.00 8.23 0.02 -1.25 -2.50 135.00 138.67 3hl9 s PRO 182 Ca 0.49 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.77 3hl9 s PRO 182 Cb -0.10 -2.49 0.00 0.00 0.02 0.00 0.00 34.50 31.93 3hl9 s PRO 182 CO 0.39 -0.91 0.00 0.41 -0.33 0.00 0.00 177.00 176.56 3hl9 n GLY 183 N 0.64 0.84 0.04 0.52 0.00 -0.54 -4.90 105.19 101.79 3hl9 n GLY 183 Ca 0.07 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.08 3hl9 n GLY 183 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3hl9 h ALA 184 N 0.00 0.00 -2.19 4.61 0.00 -1.72 -3.49 119.26 116.48 3hl9 h ALA 184 Ca 0.00 -0.16 -0.49 0.00 0.00 0.00 0.00 54.91 54.26 3hl9 h ALA 184 Cb 0.01 0.14 -0.14 0.00 0.00 0.00 0.00 17.79 17.80 3hl9 h ALA 184 CO 0.00 0.14 -0.73 -1.21 0.00 0.00 0.00 179.25 177.45 3hl9 s GLU 185 N -1.60 1.44 -0.11 0.00 2.02 -1.26 -4.89 118.70 114.30 3hl9 s GLU 185 Ca -0.04 -1.66 -0.23 0.00 0.02 0.00 0.00 54.97 53.05 3hl9 s GLU 185 Cb 0.01 -1.25 -0.03 0.00 0.10 0.00 0.00 34.13 32.95 3hl9 s GLU 185 CO 0.06 0.19 0.72 -0.46 0.02 0.00 0.00 175.26 175.78 3hl9 s TRP 186 N -2.89 3.51 -0.18 1.61 -0.00 -1.26 -4.40 118.94 115.33 3hl9 s TRP 186 Ca 0.25 1.20 -0.04 0.00 -0.00 0.00 0.00 56.10 57.51 3hl9 s TRP 186 Cb -0.01 -2.85 0.09 0.00 -0.00 0.00 0.00 33.47 30.70 3hl9 s TRP 186 CO 0.09 -0.03 0.28 0.42 -0.00 0.00 0.00 176.95 177.71 3hl9 s ILE 187 N 1.27 -0.43 0.04 5.86 1.01 -0.48 -4.94 121.20 123.54 3hl9 s ILE 187 Ca 0.36 0.06 -0.30 0.00 0.00 0.00 0.00 60.65 60.77 3hl9 s ILE 187 Cb -0.17 -0.61 -0.09 0.00 0.01 0.00 0.00 42.46 41.59 3hl9 s ILE 187 CO 0.16 -0.05 1.97 0.00 0.00 0.00 0.00 174.94 177.01 3hl9 n TYR 188 N 5.34 2.52 -4.04 3.97 9.36 -1.26 -4.68 117.16 128.38 3hl9 n TYR 188 Ca -0.05 -0.37 -0.14 0.00 3.32 0.00 0.00 57.90 60.66 3hl9 n TYR 188 Cb 0.50 -2.80 -0.03 0.00 -0.63 0.00 0.00 39.34 36.38 3hl9 n TYR 188 CO 0.00 0.00 0.00 0.20 0.22 0.00 0.00 176.86 177.28 3hl9 s GLY 189 N 4.37 1.36 0.00 2.98 0.00 -1.26 -3.27 107.32 111.50 3hl9 s GLY 189 Ca 0.89 -1.42 0.05 0.00 0.00 0.00 0.00 44.72 44.23 3hl9 s GLY 189 CO 0.42 -0.89 0.79 0.00 0.00 0.00 0.00 173.10 173.42 3hl9 n ALA 190 N -0.58 2.08 0.90 3.20 0.00 -1.26 -4.21 120.51 120.65 3hl9 n ALA 190 Ca -0.01 -0.03 0.00 0.00 0.00 0.00 0.00 53.44 53.40 3hl9 n ALA 190 Cb 0.61 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 18.99 3hl9 n ALA 190 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 3hl9 n ASN 191 N -0.63 0.33 -0.12 0.00 2.04 -1.26 -1.25 115.26 114.37 3hl9 n ASN 191 Ca 0.03 -1.23 0.05 0.00 -0.44 0.00 0.00 54.58 52.99 3hl9 n ASN 191 Cb 0.02 -0.17 -0.03 0.00 -2.53 0.00 0.00 39.78 37.07 3hl9 n ASN 191 CO 0.00 0.00 0.00 -0.11 -0.44 0.00 0.00 177.26 176.71 3hl9 n LEU 192 N -0.13 0.89 0.02 -4.53 -0.00 -1.26 -3.66 117.00 108.32 3hl9 n LEU 192 Ca 0.00 -0.62 -0.11 0.00 -0.00 0.00 0.00 56.01 55.28 3hl9 n LEU 192 Cb 0.08 0.00 -0.14 0.00 -0.00 0.00 0.00 43.42 43.37 3hl9 n LEU 192 CO 0.00 0.19 -0.36 0.44 -0.00 0.00 0.00 177.39 177.66 3hl9 h ASP 193 N 0.60 0.11 -0.35 1.96 5.19 -1.26 -2.65 116.42 120.02 3hl9 h ASP 193 Ca 0.00 -0.19 -0.04 0.00 -0.62 0.00 0.00 57.03 56.18 3hl9 h ASP 193 Cb 0.32 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 39.78 3hl9 h ASP 193 CO 0.00 1.16 0.06 -0.50 -3.12 0.00 0.00 179.24 176.84 3hl9 h TRP 194 N 0.02 0.61 -0.66 4.55 4.06 -1.76 -0.44 115.95 122.33 3hl9 h TRP 194 Ca -0.23 -0.08 0.14 0.00 2.06 0.00 0.00 58.89 60.78 3hl9 h TRP 194 Cb 1.96 -0.17 -0.10 0.00 -1.00 0.00 0.00 29.16 29.85 3hl9 h TRP 194 CO 0.02 0.64 0.11 0.00 -3.56 0.00 0.00 178.44 175.64 3hl9 h ALA 195 N 0.90 0.78 -0.26 1.49 0.00 -1.63 0.36 119.26 120.91 3hl9 h ALA 195 Ca 0.11 0.16 0.06 0.00 0.00 0.00 0.00 54.91 55.24 3hl9 h ALA 195 Cb 0.35 0.25 -0.06 0.00 0.00 0.00 0.00 17.79 18.33 3hl9 h ALA 195 CO 0.01 -0.35 -0.10 0.78 0.00 0.00 0.00 179.25 179.59 3hl9 h GLY 196 N 0.22 0.12 0.69 0.00 0.00 -1.07 -2.77 103.07 100.27 3hl9 h GLY 196 Ca 0.36 0.13 -0.00 0.00 0.00 0.00 0.00 47.33 47.82 3hl9 h GLY 196 CO -0.49 -0.13 -0.31 0.50 0.00 0.00 0.00 176.54 176.11 3hl9 h LYS 197 N -0.06 -0.64 -0.89 4.80 1.79 0.58 -2.51 116.57 119.64 3hl9 h LYS 197 Ca 0.13 0.04 0.23 0.00 -2.18 0.00 0.00 60.65 58.88 3hl9 h LYS 197 Cb 0.26 0.15 -0.16 0.00 -1.58 0.00 0.00 32.23 30.90 3hl9 h LYS 197 CO -0.30 -0.43 0.06 1.25 -1.08 0.00 0.00 179.45 178.96 3hl9 h LEU 198 N -0.67 -0.33 -0.03 2.94 6.46 -0.09 0.32 115.31 123.91 3hl9 h LEU 198 Ca -0.02 0.23 -0.00 0.00 -0.12 0.00 0.00 57.88 57.97 3hl9 h LEU 198 Cb 0.60 0.39 -0.00 0.00 -0.73 0.00 0.00 40.66 40.92 3hl9 h LEU 198 CO -0.04 -0.25 0.02 0.58 -0.62 0.00 0.00 178.44 178.12 3hl9 h VAL 199 N 0.08 1.06 -0.90 1.05 2.07 -1.35 0.19 116.25 118.45 3hl9 h VAL 199 Ca 0.53 -0.16 0.17 0.00 0.82 0.00 0.00 66.70 68.06 3hl9 h VAL 199 Cb 1.04 1.10 -0.07 0.00 -1.52 0.00 0.00 31.29 31.84 3hl9 h VAL 199 CO -0.78 0.05 0.58 -0.33 0.02 0.00 0.00 177.57 177.11 3hl9 h GLU 200 N -0.01 0.58 0.13 1.57 5.08 0.02 0.46 114.58 122.41 3hl9 h GLU 200 Ca 0.01 -0.03 -0.33 0.00 -1.00 0.00 0.00 59.36 58.01 3hl9 h GLU 200 Cb 0.06 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.17 3hl9 h GLU 200 CO -0.00 0.38 -1.70 0.00 -1.00 0.00 0.00 179.01 176.70 3hl9 h ARG 201 N 0.60 0.28 0.00 2.33 2.47 -0.95 -1.55 114.38 117.56 3hl9 h ARG 201 Ca 0.47 -0.48 -0.10 0.00 -1.26 0.00 0.00 59.98 58.61 3hl9 h ARG 201 Cb 0.89 0.18 -0.01 0.00 -1.65 0.00 0.00 29.97 29.38 3hl9 h ARG 201 CO -0.21 1.15 -0.47 0.00 0.56 0.00 0.00 179.97 181.00 3hl9 h ALA 202 N 0.34 1.12 -0.20 0.04 0.00 -0.58 -3.26 119.26 116.72 3hl9 h ALA 202 Ca -0.31 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.17 3hl9 h ALA 202 Cb 2.05 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.76 3hl9 h ALA 202 CO 0.15 0.59 0.00 0.25 0.00 0.00 0.00 179.25 180.24 3hl9 n THR 203 N -3.83 0.55 -1.90 0.00 -2.24 0.12 -4.98 114.28 101.99 3hl9 n THR 203 Ca -0.01 -0.77 -0.07 0.00 -2.27 0.00 0.00 64.05 60.93 3hl9 n THR 203 Cb 0.51 0.83 -0.01 0.00 -2.10 0.00 0.00 70.33 69.56 3hl9 n THR 203 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3hl9 n GLY 204 N 0.59 0.02 3.22 3.38 0.00 -0.61 -4.93 105.19 106.86 3hl9 n GLY 204 Ca 0.10 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.86 3hl9 n GLY 204 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hl9 s LEU 205 N -4.25 2.09 0.58 0.99 1.43 -1.02 -5.03 118.68 113.48 3hl9 s LEU 205 Ca 0.00 -0.42 -0.17 0.00 -1.03 0.00 0.00 54.13 52.51 3hl9 s LEU 205 Cb 0.00 -0.98 -0.04 0.00 0.03 0.00 0.00 46.19 45.20 3hl9 s LEU 205 CO 0.00 0.20 1.09 1.51 0.23 0.00 0.00 176.35 179.38 3hl9 s ASP 206 N -0.77 5.66 0.00 2.29 -4.77 -1.26 -4.03 116.67 113.79 3hl9 s ASP 206 Ca 0.07 1.97 0.28 0.00 -3.30 0.00 0.00 52.55 51.57 3hl9 s ASP 206 Cb -0.08 -2.55 1.56 0.00 -1.09 0.00 0.00 42.92 40.76 3hl9 s ASP 206 CO 0.00 -1.25 1.99 0.00 0.70 0.00 0.00 175.17 176.61 3hl9 n LEU 207 N -1.82 0.00 -0.00 2.11 -0.00 -1.26 -2.10 117.00 113.93 3hl9 n LEU 207 Ca 0.10 0.12 -0.13 0.00 -0.00 0.00 0.00 56.01 56.10 3hl9 n LEU 207 Cb 0.52 -0.12 -0.10 0.00 -0.00 0.00 0.00 43.42 43.73 3hl9 n LEU 207 CO 0.45 -0.01 0.58 -0.08 -0.00 0.00 0.00 177.39 178.33 3hl9 h GLU 208 N 0.00 -0.05 0.16 1.47 4.57 -1.91 -1.60 114.58 117.21 3hl9 h GLU 208 Ca 0.00 0.00 -0.01 0.00 -1.18 0.00 0.00 59.36 58.18 3hl9 h GLU 208 Cb 0.10 0.01 0.00 0.00 -0.16 0.00 0.00 28.75 28.71 3hl9 h GLU 208 CO 0.00 0.47 -0.08 0.37 -1.18 0.00 0.00 179.01 178.59 3hl9 h GLN 209 N -0.59 -0.20 -0.70 1.92 4.15 -1.83 -2.76 115.11 115.10 3hl9 h GLN 209 Ca -0.01 0.01 0.10 0.00 0.77 0.00 0.00 58.65 59.53 3hl9 h GLN 209 Cb 0.54 0.05 -0.05 0.00 0.21 0.00 0.00 27.48 28.23 3hl9 h GLN 209 CO 0.01 -0.14 0.46 -0.92 -1.93 0.00 0.00 178.83 176.31 3hl9 h TYR 210 N -0.21 0.59 -0.25 3.99 5.03 -1.52 -1.92 116.97 122.67 3hl9 h TYR 210 Ca -0.02 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.28 3hl9 h TYR 210 Cb 0.16 -0.19 -0.01 0.00 1.55 0.00 0.00 36.73 38.24 3hl9 h TYR 210 CO -0.07 0.28 0.05 1.25 -1.32 0.00 0.00 178.16 178.34 3hl9 h LEU 211 N 0.55 0.40 -0.71 2.82 5.85 -1.01 -0.91 115.31 122.30 3hl9 h LEU 211 Ca 0.32 -0.25 -0.11 0.00 0.84 0.00 0.00 57.88 58.68 3hl9 h LEU 211 Cb 0.52 -0.11 -0.02 0.00 0.37 0.00 0.00 40.66 41.43 3hl9 h LEU 211 CO -0.11 0.55 -0.15 1.56 -0.34 0.00 0.00 178.44 179.95 3hl9 h GLN 212 N 0.23 0.83 -0.18 1.25 1.08 -1.20 -1.87 115.11 115.25 3hl9 h GLN 212 Ca 0.08 -0.31 -0.19 0.00 -1.45 0.00 0.00 58.65 56.79 3hl9 h GLN 212 Cb 0.32 -0.05 0.01 0.00 -0.05 0.00 0.00 27.48 27.70 3hl9 h GLN 212 CO 0.00 0.93 -0.61 0.93 -0.95 0.00 0.00 178.83 179.14 3hl9 h GLU 213 N 0.74 0.74 -0.01 1.46 5.08 -1.25 0.36 114.58 121.70 3hl9 h GLU 213 Ca 0.11 -0.55 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 3hl9 h GLU 213 Cb 0.67 0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.01 3hl9 h GLU 213 CO 0.05 1.17 -0.17 0.09 -1.00 0.00 0.00 179.01 179.15 3hl9 n ASN 214 N -4.06 1.67 0.01 1.42 3.02 -0.36 -4.53 115.26 112.43 3hl9 n ASN 214 Ca -0.07 -1.34 0.00 0.00 -0.03 0.00 0.00 54.58 53.15 3hl9 n ASN 214 Cb 0.66 0.30 0.00 0.00 -0.61 0.00 0.00 39.78 40.12 3hl9 n ASN 214 CO 0.00 0.00 0.00 -0.38 -2.62 0.00 0.00 177.26 174.26 3hl9 n ILE 215 N 0.16 0.01 0.09 2.41 5.41 -0.75 -4.83 119.36 121.86 3hl9 n ILE 215 Ca 0.06 0.00 -0.12 0.00 1.00 0.00 0.00 62.75 63.70 3hl9 n ILE 215 Cb 0.30 -0.73 -0.08 0.00 -0.71 0.00 0.00 39.64 38.42 3hl9 n ILE 215 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 3hl9 h ALA 217 N -0.29 -0.53 -0.96 0.00 0.00 -1.15 0.25 119.26 116.58 3hl9 h ALA 217 Ca -0.03 0.02 0.23 0.00 0.00 0.00 0.00 54.91 55.12 3hl9 h ALA 217 Cb 0.51 0.84 -0.08 0.00 0.00 0.00 0.00 17.79 19.06 3hl9 h ALA 217 CO 0.05 -0.91 0.63 -1.35 0.00 0.00 0.00 179.25 177.67 3hl9 h PRO 218 N -0.42 0.40 -0.57 0.00 0.11 -1.80 -0.64 132.00 129.09 3hl9 h PRO 218 Ca 0.10 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.18 3hl9 h PRO 218 Cb 0.61 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.63 3hl9 h PRO 218 CO -0.47 0.27 0.00 1.28 -0.21 0.00 0.00 178.00 178.87 3hl9 n LEU 219 N -4.55 3.72 -3.53 2.35 4.77 -0.98 -4.99 117.00 113.80 3hl9 n LEU 219 Ca 0.22 -2.11 -0.24 0.00 -0.03 0.00 0.00 56.01 53.84 3hl9 n LEU 219 Cb 0.76 -0.42 0.04 0.00 -2.33 0.00 0.00 43.42 41.48 3hl9 n LEU 219 CO 0.29 0.86 -0.01 0.61 -1.33 0.00 0.00 177.39 177.81 3hl9 n GLY 220 N 1.08 -1.09 3.63 -0.72 0.00 -0.19 -5.00 105.19 102.90 3hl9 n GLY 220 Ca 0.20 0.50 -0.34 0.00 0.00 0.00 0.00 46.02 46.38 3hl9 n GLY 220 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hl9 s ILE 221 N -3.35 3.97 0.00 -0.61 1.01 0.71 -5.01 121.20 117.92 3hl9 s ILE 221 Ca 0.38 -0.46 0.00 0.00 0.00 0.00 0.00 60.65 60.57 3hl9 s ILE 221 Cb -0.11 -2.68 0.00 0.00 0.01 0.00 0.00 42.46 39.68 3hl9 s ILE 221 CO 0.83 0.54 0.18 0.35 0.00 0.00 0.00 174.94 176.84 3hl9 n THR 222 N 1.97 0.00 -0.55 2.92 -2.24 -1.26 -4.52 114.28 110.60 3hl9 n THR 222 Ca -0.17 -0.28 0.08 0.00 -2.27 0.00 0.00 64.05 61.40 3hl9 n THR 222 Cb 0.53 1.28 0.25 0.00 -2.10 0.00 0.00 70.33 70.29 3hl9 n THR 222 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 3hl9 n ASP 223 N -0.20 3.77 -4.63 3.42 5.68 -1.26 -4.94 116.55 118.38 3hl9 n ASP 223 Ca 0.00 -2.43 -0.37 0.00 -0.50 0.00 0.00 54.79 51.49 3hl9 n ASP 223 Cb 0.07 -0.43 -0.10 0.00 -1.14 0.00 0.00 41.12 39.52 3hl9 n ASP 223 CO 0.00 0.00 0.00 -0.32 -1.33 0.00 0.00 177.20 175.55 3hl9 s MET 224 N -1.78 4.04 -0.10 0.11 1.75 -1.26 -3.57 119.30 118.49 3hl9 s MET 224 Ca 0.37 -0.19 -0.31 0.00 -1.25 0.00 0.00 55.69 54.32 3hl9 s MET 224 Cb 0.25 -3.59 0.09 0.00 2.84 0.00 0.00 34.83 34.42 3hl9 s MET 224 CO 0.17 -0.07 0.82 -0.08 -0.65 0.00 0.00 175.02 175.21 3hl9 s THR 225 N 1.42 0.00 -0.05 10.11 -1.32 -0.62 -4.94 115.64 120.25 3hl9 s THR 225 Ca 0.10 0.00 -0.15 0.00 -1.21 0.00 0.00 61.69 60.42 3hl9 s THR 225 Cb -0.15 -1.00 -0.31 0.00 -1.51 0.00 0.00 72.50 69.54 3hl9 s THR 225 CO 0.08 0.00 0.73 -0.26 -2.21 0.00 0.00 174.62 172.95 3hl9 h PHE 226 N 2.85 0.65 -2.79 9.09 0.04 -1.85 -0.96 116.94 123.97 3hl9 h PHE 226 Ca -0.23 -0.48 -0.77 0.00 2.80 0.00 0.00 57.97 59.29 3hl9 h PHE 226 Cb 1.15 -0.03 -0.23 0.00 2.20 0.00 0.00 35.95 39.05 3hl9 h PHE 226 CO 0.34 1.56 0.96 1.63 -0.60 0.00 0.00 178.31 182.21 3hl9 n LYS 227 N -3.81 3.53 0.05 1.51 4.76 -1.26 -4.80 118.16 118.14 3hl9 n LYS 227 Ca -0.22 -4.15 -0.16 0.00 -2.87 0.00 0.00 58.31 50.91 3hl9 n LYS 227 Cb 0.98 -2.78 -0.06 0.00 -1.84 0.00 0.00 35.03 31.33 3hl9 n LYS 227 CO 0.00 0.00 0.00 1.25 -1.37 0.00 0.00 177.40 177.28 3hl9 h LEU 228 N 7.97 0.72 -1.76 -0.35 7.12 -1.97 -2.85 115.31 124.19 3hl9 h LEU 228 Ca 0.25 -0.55 0.00 0.00 0.13 0.00 0.00 57.88 57.71 3hl9 h LEU 228 Cb 0.84 -0.22 0.00 0.00 -0.53 0.00 0.00 40.66 40.75 3hl9 h LEU 228 CO 1.17 1.35 0.41 0.06 -0.13 0.00 0.00 178.44 181.30 3hl9 h GLN 229 N 0.33 0.00 -0.73 1.25 -0.00 -1.99 0.30 115.11 114.28 3hl9 h GLN 229 Ca -0.09 0.00 -0.08 0.00 -0.00 0.00 0.00 58.65 58.48 3hl9 h GLN 229 Cb 1.58 0.00 -0.05 0.00 -0.00 0.00 0.00 27.48 29.01 3hl9 h GLN 229 CO 0.18 0.00 0.10 1.04 -0.00 0.00 0.00 178.83 180.15 3hl9 n GLN 230 N -2.84 3.75 -3.34 0.06 6.02 -1.08 -4.70 117.38 115.26 3hl9 n GLN 230 Ca -0.02 -2.53 -0.26 0.00 -0.01 0.00 0.00 57.00 54.18 3hl9 n GLN 230 Cb 0.45 -2.09 -0.09 0.00 1.02 0.00 0.00 30.24 29.53 3hl9 n GLN 230 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 3hl9 n ARG 231 N 0.24 0.60 -0.23 -1.09 5.12 0.11 -5.00 116.66 116.41 3hl9 n ARG 231 Ca 0.28 -3.33 0.02 0.00 -1.93 0.00 0.00 57.85 52.88 3hl9 n ARG 231 Cb 1.11 -1.54 0.13 0.00 -1.16 0.00 0.00 32.46 31.00 3hl9 n ARG 231 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 3hl9 h PRO 232 N 4.88 0.44 -0.95 5.56 0.13 -1.84 0.23 132.00 140.45 3hl9 h PRO 232 Ca 0.18 -0.03 0.13 0.00 -0.87 0.00 0.00 66.00 65.41 3hl9 h PRO 232 Cb 0.88 -0.10 -0.14 0.00 0.13 0.00 0.00 31.00 31.76 3hl9 h PRO 232 CO 0.45 0.29 -0.42 -0.40 -0.23 0.00 0.00 178.00 177.69 3hl9 n ASP 233 N -4.98 -0.71 -0.02 1.44 5.68 -1.26 -2.22 116.55 114.48 3hl9 n ASP 233 Ca 0.11 1.66 0.02 0.00 -0.50 0.00 0.00 54.79 56.08 3hl9 n ASP 233 Cb 0.31 -0.34 -0.14 0.00 -1.14 0.00 0.00 41.12 39.81 3hl9 n ASP 233 CO 0.00 0.00 0.00 1.15 -1.33 0.00 0.00 177.20 177.02 3hl9 n MET 234 N -5.35 0.66 -0.30 0.11 0.00 -0.63 -4.20 117.12 107.40 3hl9 n MET 234 Ca 0.08 -0.03 0.01 0.00 0.00 0.00 0.00 57.70 57.76 3hl9 n MET 234 Cb 0.35 -1.60 0.15 0.00 0.00 0.00 0.00 33.22 32.12 3hl9 n MET 234 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 175.97 177.22 3hl9 h LEU 235 N 0.00 0.78 -1.72 3.17 6.46 -0.42 -1.79 115.31 121.80 3hl9 h LEU 235 Ca -0.21 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 57.56 3hl9 h LEU 235 Cb 1.53 -0.13 -0.01 0.00 -0.73 0.00 0.00 40.66 41.31 3hl9 h LEU 235 CO 0.02 0.49 0.07 0.00 -0.62 0.00 0.00 178.44 178.39 3hl9 h ALA 236 N 1.41 1.78 -0.50 1.25 0.00 -1.61 -3.04 119.26 118.55 3hl9 h ALA 236 Ca 0.38 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 55.23 3hl9 h ALA 236 Cb 0.22 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.93 3hl9 h ALA 236 CO -0.19 0.18 0.00 2.89 0.00 0.00 0.00 179.25 182.13 3hl9 n ARG 237 N -4.45 3.39 -0.92 0.00 1.85 -0.72 -5.02 116.66 110.78 3hl9 n ARG 237 Ca -0.00 -2.70 -0.31 0.00 -1.00 0.00 0.00 57.85 53.84 3hl9 n ARG 237 Cb 0.12 -1.75 0.14 0.00 -1.05 0.00 0.00 32.46 29.93 3hl9 n ARG 237 CO 0.00 0.00 0.00 -0.98 -0.01 0.00 0.00 177.63 176.64 3hl9 s ARG 238 N -1.86 1.36 -0.03 2.89 1.70 -0.91 -4.31 118.95 117.79 3hl9 s ARG 238 Ca 0.43 1.32 -0.27 0.00 -0.47 0.00 0.00 55.73 56.74 3hl9 s ARG 238 Cb 0.29 -1.78 -0.03 0.00 -0.57 0.00 0.00 34.95 32.85 3hl9 s ARG 238 CO 0.20 -2.32 0.86 0.00 -1.08 0.00 0.00 175.30 172.96 3hl9 s ALA 239 N -2.75 3.24 0.36 7.88 0.00 0.58 -4.91 121.76 126.17 3hl9 s ALA 239 Ca 0.65 0.36 -0.25 0.00 0.00 0.00 0.00 51.96 52.72 3hl9 s ALA 239 Cb -0.21 -3.18 -0.10 0.00 0.00 0.00 0.00 23.12 19.63 3hl9 s ALA 239 CO 0.58 -0.19 0.97 -0.51 0.00 0.00 0.00 175.76 176.60 3hl9 s ASP 240 N 0.93 7.15 0.40 0.00 1.01 -1.18 -4.84 116.67 120.13 3hl9 s ASP 240 Ca 0.46 1.86 -0.25 0.00 0.71 0.00 0.00 52.55 55.32 3hl9 s ASP 240 Cb -0.20 -2.57 -0.08 0.00 1.01 0.00 0.00 42.92 41.08 3hl9 s ASP 240 CO 0.23 -0.21 1.16 -1.10 0.21 0.00 0.00 175.17 175.46 3hl9 s GLN 241 N -2.34 4.08 0.01 8.23 -1.52 -1.26 -4.57 119.66 122.30 3hl9 s GLN 241 Ca 0.54 1.81 0.09 0.00 -1.95 0.00 0.00 55.36 55.84 3hl9 s GLN 241 Cb -0.18 -2.68 -0.02 0.00 -0.22 0.00 0.00 33.01 29.91 3hl9 s GLN 241 CO 0.23 -0.29 -0.26 0.99 -0.25 0.00 0.00 175.29 175.71 3hl9 s THR 242 N -1.43 2.14 -0.04 -0.19 2.01 -0.97 -1.62 115.64 115.54 3hl9 s THR 242 Ca 0.57 -1.24 0.03 0.00 0.31 0.00 0.00 61.69 61.36 3hl9 s THR 242 Cb -0.30 -1.79 0.00 0.00 0.01 0.00 0.00 72.50 70.42 3hl9 s THR 242 CO 0.38 0.47 -0.13 -2.28 -0.69 0.00 0.00 174.62 172.36 3hl9 s HIS 243 N -0.72 1.33 -0.04 4.92 2.46 -0.43 0.17 115.29 122.97 3hl9 s HIS 243 Ca 0.11 -0.37 -0.14 0.00 0.47 0.00 0.00 55.06 55.13 3hl9 s HIS 243 Cb -0.10 -0.92 -0.05 0.00 -0.13 0.00 0.00 32.58 31.38 3hl9 s HIS 243 CO 0.01 -0.14 0.37 0.50 -2.47 0.00 0.00 174.74 173.00 3hl9 s ARG 244 N 0.17 3.92 0.26 2.88 3.52 -0.81 0.10 118.95 129.00 3hl9 s ARG 244 Ca -0.04 0.31 -0.17 0.00 -0.13 0.00 0.00 55.73 55.70 3hl9 s ARG 244 Cb -0.10 -3.25 -0.09 0.00 -1.56 0.00 0.00 34.95 29.95 3hl9 s ARG 244 CO 0.01 0.62 0.72 -0.80 -0.81 0.00 0.00 175.30 175.05 3hl9 s ASN 245 N -0.80 6.92 0.20 -2.12 0.01 0.44 -4.78 114.94 114.81 3hl9 s ASN 245 Ca 0.22 1.34 -0.06 0.00 -0.71 0.00 0.00 52.86 53.65 3hl9 s ASN 245 Cb -0.16 -2.39 0.13 0.00 0.41 0.00 0.00 41.25 39.24 3hl9 s ASN 245 CO 0.11 -0.07 1.58 0.28 -1.51 0.00 0.00 177.10 177.49 3hl9 h SER 246 N 2.89 0.82 0.22 -1.22 0.02 -1.98 -1.99 113.55 112.31 3hl9 h SER 246 Ca -0.48 -0.33 -0.01 0.00 -0.84 0.00 0.00 61.79 60.13 3hl9 h SER 246 Cb 1.18 -0.23 0.00 0.00 0.14 0.00 0.00 62.40 63.50 3hl9 h SER 246 CO 0.65 1.05 -0.11 0.00 -1.14 0.00 0.00 176.83 177.29 3hl9 h ALA 247 N 1.00 -0.30 0.00 3.77 0.00 -1.96 -3.38 119.26 118.38 3hl9 h ALA 247 Ca 0.08 -0.14 -0.19 0.00 0.00 0.00 0.00 54.91 54.66 3hl9 h ALA 247 Cb 0.82 0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 3hl9 h ALA 247 CO 0.07 -0.57 -1.07 -0.44 0.00 0.00 0.00 179.25 177.24 3hl9 h ASP 248 N -0.50 0.00 0.00 0.00 5.19 -1.99 -3.48 116.42 115.65 3hl9 h ASP 248 Ca -0.03 -0.54 0.00 0.00 -0.62 0.00 0.00 57.03 55.84 3hl9 h ASP 248 Cb 0.37 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.88 3hl9 h ASP 248 CO 0.05 1.39 0.00 0.61 -3.12 0.00 0.00 179.24 178.17 3hl9 n GLY 249 N 1.46 0.60 3.93 2.75 0.00 -0.75 -5.05 105.19 108.13 3hl9 n GLY 249 Ca -0.28 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.49 3hl9 n GLY 249 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3hl9 s ARG 250 N -0.80 3.24 0.08 1.61 0.52 -1.26 -4.77 118.95 117.56 3hl9 s ARG 250 Ca 0.00 -0.14 0.09 0.00 -0.52 0.00 0.00 55.73 55.16 3hl9 s ARG 250 Cb 0.00 -2.45 -0.03 0.00 0.52 0.00 0.00 34.95 32.99 3hl9 s ARG 250 CO 0.00 -0.29 -0.22 -0.48 0.02 0.00 0.00 175.30 174.33 3hl9 s LEU 251 N -4.68 2.46 0.20 2.53 0.05 -1.26 -0.42 118.68 117.56 3hl9 s LEU 251 Ca 0.48 -0.57 0.03 0.00 0.05 0.00 0.00 54.13 54.12 3hl9 s LEU 251 Cb -0.10 -1.40 -0.05 0.00 -2.05 0.00 0.00 46.19 42.59 3hl9 s LEU 251 CO 0.41 0.22 -0.01 0.00 -0.55 0.00 0.00 176.35 176.43 3hl9 s ARG 252 N -1.69 1.24 0.87 1.48 1.70 0.12 -4.97 118.95 117.69 3hl9 s ARG 252 Ca 0.14 -1.61 -0.10 0.00 -0.47 0.00 0.00 55.73 53.69 3hl9 s ARG 252 Cb -0.10 -0.49 0.12 0.00 -0.57 0.00 0.00 34.95 33.90 3hl9 s ARG 252 CO 0.06 -0.10 1.11 -0.47 -1.08 0.00 0.00 175.30 174.82 3hl9 s TYR 253 N -3.50 2.04 0.00 5.89 5.04 -1.26 -1.32 117.35 124.24 3hl9 s TYR 253 Ca 0.26 1.63 0.00 0.00 -2.44 0.00 0.00 57.07 56.52 3hl9 s TYR 253 Cb 0.06 -3.20 0.00 0.00 0.35 0.00 0.00 41.96 39.17 3hl9 s TYR 253 CO 0.06 -2.43 0.00 -3.47 -1.34 0.00 0.00 175.55 168.38 3hl9 n ASP 254 N -3.96 1.62 -2.42 4.32 2.03 -0.64 -4.53 116.55 112.97 3hl9 n ASP 254 Ca 0.10 0.00 -0.29 0.00 0.52 0.00 0.00 54.79 55.12 3hl9 n ASP 254 Cb 0.53 0.00 0.02 0.00 -0.72 0.00 0.00 41.12 40.95 3hl9 n ASP 254 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 3hl9 s PHE 267 N -3.67 3.53 1.10 0.00 0.08 -1.26 -4.81 117.98 112.95 3hl9 s PHE 267 Ca 0.51 1.06 -0.13 0.00 0.12 0.00 0.00 56.93 58.49 3hl9 s PHE 267 Cb 0.42 -2.38 0.24 0.00 -0.57 0.00 0.00 43.02 40.73 3hl9 s PHE 267 CO -0.15 0.34 1.06 0.20 -0.10 0.00 0.00 175.22 176.57 3hl9 s GLY 268 N -1.95 1.55 0.00 4.36 0.00 -1.26 -4.00 107.32 106.02 3hl9 s GLY 268 Ca 0.43 -0.36 0.00 0.00 0.00 0.00 0.00 44.72 44.78 3hl9 s GLY 268 CO 0.20 0.33 0.00 0.61 0.00 0.00 0.00 173.10 174.24 3hl9 n GLY 269 N -0.31 2.59 3.54 0.20 0.00 -1.20 -3.74 105.19 106.28 3hl9 n GLY 269 Ca 0.05 -0.14 -0.10 0.00 0.00 0.00 0.00 46.02 45.82 3hl9 n GLY 269 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 3hl9 s GLN 270 N 0.00 1.38 0.00 1.61 1.03 -1.26 -4.07 119.66 118.35 3hl9 s GLN 270 Ca 0.00 -0.59 0.00 0.00 0.04 0.00 0.00 55.36 54.81 3hl9 s GLN 270 Cb 0.00 0.58 0.00 0.00 0.03 0.00 0.00 33.01 33.62 3hl9 s GLN 270 CO 0.00 -0.61 0.00 0.41 -2.54 0.00 0.00 175.29 172.55 3hl9 n GLY 271 N -0.39 0.97 3.74 2.60 0.00 -1.24 -4.60 105.19 106.27 3hl9 n GLY 271 Ca -0.13 -0.13 -0.33 0.00 0.00 0.00 0.00 46.02 45.43 3hl9 n GLY 271 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3hl9 s VAL 272 N -2.16 4.48 -0.19 1.61 1.01 -1.26 -4.67 120.40 119.22 3hl9 s VAL 272 Ca 0.00 -0.47 -0.03 0.00 0.00 0.00 0.00 61.98 61.47 3hl9 s VAL 272 Cb 0.00 -3.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.34 3hl9 s VAL 272 CO 0.00 0.38 -0.05 -0.36 0.00 0.00 0.00 175.10 175.07 3hl9 s PHE 273 N -1.13 2.96 0.08 5.22 0.08 -0.36 -1.31 117.98 123.51 3hl9 s PHE 273 Ca 0.21 -0.67 -0.09 0.00 0.12 0.00 0.00 56.93 56.49 3hl9 s PHE 273 Cb -0.12 -2.03 0.00 0.00 -0.57 0.00 0.00 43.02 40.30 3hl9 s PHE 273 CO 0.12 -0.34 0.21 -1.54 -0.10 0.00 0.00 175.22 173.56 3hl9 s SER 274 N 1.00 0.08 0.26 1.36 1.04 -0.50 -1.58 113.70 115.36 3hl9 s SER 274 Ca 0.00 -0.58 -0.29 0.00 0.48 0.00 0.00 55.95 55.56 3hl9 s SER 274 Cb -0.15 0.34 -0.09 0.00 0.10 0.00 0.00 66.02 66.22 3hl9 s SER 274 CO 0.00 -0.71 1.26 -0.83 0.98 0.00 0.00 173.24 173.94 3hl9 s GLY 275 N -2.72 2.80 0.51 7.32 0.00 -1.23 -1.97 107.32 112.02 3hl9 s GLY 275 Ca 0.03 1.11 0.17 0.00 0.00 0.00 0.00 44.72 46.03 3hl9 s GLY 275 CO -0.10 1.88 2.12 -0.56 0.00 0.00 0.00 173.10 176.44 3hl9 h PRO 276 N 4.30 0.00 -0.46 2.90 0.13 -1.70 -1.68 132.00 135.48 3hl9 h PRO 276 Ca -0.47 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.62 3hl9 h PRO 276 Cb 1.22 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.33 3hl9 h PRO 276 CO 0.71 0.05 0.10 0.78 -0.23 0.00 0.00 178.00 179.40 3hl9 h GLY 277 N 0.14 0.75 0.78 1.56 0.00 -1.67 -2.77 103.07 101.87 3hl9 h GLY 277 Ca -0.00 -0.42 -0.12 0.00 0.00 0.00 0.00 47.33 46.78 3hl9 h GLY 277 CO 0.01 0.40 -0.44 1.76 0.00 0.00 0.00 176.54 178.26 3hl9 h SER 278 N 0.68 0.51 -0.86 0.19 0.02 -1.53 -3.07 113.55 109.49 3hl9 h SER 278 Ca 0.15 -0.67 0.16 0.00 -0.84 0.00 0.00 61.79 60.60 3hl9 h SER 278 Cb 0.27 -0.15 -0.10 0.00 0.14 0.00 0.00 62.40 62.56 3hl9 h SER 278 CO -0.00 1.10 0.42 0.22 -1.14 0.00 0.00 176.83 177.43 3hl9 h TYR 279 N -0.04 0.74 0.13 3.45 3.20 -1.39 -1.16 116.97 121.91 3hl9 h TYR 279 Ca -0.03 0.04 0.02 0.00 3.14 0.00 0.00 58.73 61.89 3hl9 h TYR 279 Cb 1.10 -0.20 -0.04 0.00 1.54 0.00 0.00 36.73 39.13 3hl9 h TYR 279 CO 0.13 0.13 -0.37 1.98 -1.64 0.00 0.00 178.16 178.38 3hl9 h MET 280 N 0.57 -0.59 -1.00 1.82 4.05 -1.46 -2.03 114.93 116.29 3hl9 h MET 280 Ca 0.49 0.04 0.38 0.00 -0.28 0.00 0.00 59.70 60.33 3hl9 h MET 280 Cb 0.75 0.13 -0.17 0.00 -0.80 0.00 0.00 31.60 31.51 3hl9 h MET 280 CO -0.40 -0.39 0.48 0.87 0.23 0.00 0.00 176.91 177.69 3hl9 h LYS 281 N -0.61 0.06 0.25 0.39 1.57 -1.12 0.92 116.57 118.02 3hl9 h LYS 281 Ca 0.02 -0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 3hl9 h LYS 281 Cb 0.64 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.94 3hl9 h LYS 281 CO -0.21 0.04 -0.12 0.28 -0.57 0.00 0.00 179.45 178.87 3hl9 h VAL 282 N 0.06 0.81 -0.24 0.50 2.07 -1.25 -2.25 116.25 115.95 3hl9 h VAL 282 Ca 0.80 -0.46 0.07 0.00 0.82 0.00 0.00 66.70 67.92 3hl9 h VAL 282 Cb 2.01 1.07 -0.01 0.00 -1.52 0.00 0.00 31.29 32.84 3hl9 h VAL 282 CO -0.76 0.10 0.19 -0.07 0.02 0.00 0.00 177.57 177.05 3hl9 h LEU 283 N -0.57 0.00 0.43 2.57 3.38 0.13 -2.88 115.31 118.37 3hl9 h LEU 283 Ca -0.03 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 3hl9 h LEU 283 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.17 3hl9 h LEU 283 CO 0.06 0.00 -0.21 -0.74 0.09 0.00 0.00 178.44 177.64 3hl9 h HIS 284 N 0.00 -0.53 -0.91 1.13 2.76 -0.62 -2.10 115.15 114.87 3hl9 h HIS 284 Ca 0.11 -0.01 0.21 0.00 -2.20 0.00 0.00 60.37 58.48 3hl9 h HIS 284 Cb 0.49 0.18 -0.12 0.00 1.55 0.00 0.00 27.41 29.50 3hl9 h HIS 284 CO 0.00 -0.33 0.45 0.66 -1.30 0.00 0.00 177.93 177.41 3hl9 h SER 285 N -1.14 0.46 0.33 3.26 4.64 -1.28 0.45 113.55 120.27 3hl9 h SER 285 Ca -0.06 0.14 -0.02 0.00 -0.47 0.00 0.00 61.79 61.38 3hl9 h SER 285 Cb 0.44 0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.61 3hl9 h SER 285 CO 0.10 0.08 -0.16 -0.07 -0.87 0.00 0.00 176.83 175.91 3hl9 h LEU 286 N 0.50 -0.38 -0.77 5.97 3.38 -1.58 -2.17 115.31 120.25 3hl9 h LEU 286 Ca 0.56 -0.03 0.14 0.00 0.09 0.00 0.00 57.88 58.64 3hl9 h LEU 286 Cb 1.01 0.10 -0.09 0.00 0.09 0.00 0.00 40.66 41.76 3hl9 h LEU 286 CO -0.48 -0.22 0.34 0.25 0.09 0.00 0.00 178.44 178.42 3hl9 h LEU 287 N -0.51 0.35 -3.88 1.67 5.85 0.55 -2.62 115.31 116.73 3hl9 h LEU 287 Ca -0.05 0.10 -0.59 0.00 0.84 0.00 0.00 57.88 58.18 3hl9 h LEU 287 Cb 0.38 0.06 -0.31 0.00 0.37 0.00 0.00 40.66 41.16 3hl9 h LEU 287 CO 0.07 0.14 0.33 2.29 -0.34 0.00 0.00 178.44 180.94 3hl9 n LYS 288 N -4.96 2.83 -0.60 1.25 2.85 -0.29 -4.91 118.16 114.33 3hl9 n LYS 288 Ca 0.15 -3.49 -0.01 0.00 -1.05 0.00 0.00 58.31 53.90 3hl9 n LYS 288 Cb 0.41 -2.24 -0.01 0.00 -0.65 0.00 0.00 35.03 32.54 3hl9 n LYS 288 CO 0.00 0.00 0.00 2.89 -0.05 0.00 0.00 177.40 180.24 3hl9 n ARG 289 N -0.90 -1.89 0.07 -1.58 0.00 -0.99 -4.69 116.66 106.69 3hl9 n ARG 289 Ca 0.55 0.29 0.07 0.00 -0.00 0.00 0.00 57.85 58.76 3hl9 n ARG 289 Cb 0.86 -3.85 0.33 0.00 -0.00 0.00 0.00 32.46 29.79 3hl9 n ARG 289 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 3hl9 n ASP 290 N 0.91 0.29 0.00 2.89 5.75 -0.84 -4.69 116.55 120.86 3hl9 n ASP 290 Ca -0.01 0.61 0.00 0.00 -0.01 0.00 0.00 54.79 55.37 3hl9 n ASP 290 Cb 0.25 -0.66 0.00 0.00 -1.03 0.00 0.00 41.12 39.69 3hl9 n ASP 290 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3hl9 n GLY 291 N -0.82 0.45 0.24 6.12 0.00 -1.25 -4.88 105.19 105.04 3hl9 n GLY 291 Ca 0.01 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 3hl9 n GLY 291 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3hl9 h LEU 292 N 0.00 0.54 0.00 0.99 4.07 -1.89 -3.34 115.31 115.68 3hl9 h LEU 292 Ca 0.00 -0.19 0.00 0.00 0.08 0.00 0.00 57.88 57.77 3hl9 h LEU 292 Cb 0.20 -0.15 0.00 0.00 1.08 0.00 0.00 40.66 41.80 3hl9 h LEU 292 CO 0.00 0.79 -0.45 0.00 -1.08 0.00 0.00 178.44 177.70 3hl9 n LEU 293 N -4.11 0.00 -4.07 1.67 -0.00 -1.26 -4.95 117.00 104.28 3hl9 n LEU 293 Ca -0.00 -0.24 -0.12 0.00 -0.00 0.00 0.00 56.01 55.64 3hl9 n LEU 293 Cb 0.42 0.00 -0.05 0.00 -0.00 0.00 0.00 43.42 43.79 3hl9 n LEU 293 CO 0.43 0.00 0.10 -0.22 -0.00 0.00 0.00 177.39 177.70 3hl9 s LEU 294 N -2.31 0.78 -0.25 1.47 2.96 -1.26 -4.86 118.68 115.22 3hl9 s LEU 294 Ca 0.00 -1.28 -0.01 0.00 -0.22 0.00 0.00 54.13 52.63 3hl9 s LEU 294 Cb 0.00 1.42 0.03 0.00 0.50 0.00 0.00 46.19 48.15 3hl9 s LEU 294 CO 0.00 -1.18 -0.07 -1.58 -1.32 0.00 0.00 176.35 172.20 3hl9 s GLN 295 N -3.54 2.71 0.09 1.98 0.74 -1.26 -3.97 119.66 116.41 3hl9 s GLN 295 Ca 0.29 -1.06 0.02 0.00 0.05 0.00 0.00 55.36 54.66 3hl9 s GLN 295 Cb 0.01 -2.96 0.26 0.00 1.10 0.00 0.00 33.01 31.41 3hl9 s GLN 295 CO 0.15 -0.44 0.43 -2.30 -0.55 0.00 0.00 175.29 172.58 3hl9 n PRO 296 N 4.62 -0.02 -0.03 1.67 -0.02 -1.26 0.14 135.00 140.10 3hl9 n PRO 296 Ca -0.16 0.40 -0.09 0.00 -2.02 0.00 0.00 63.50 61.63 3hl9 n PRO 296 Cb 0.46 -0.66 -0.03 0.00 -0.02 0.00 0.00 33.50 33.25 3hl9 n PRO 296 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 3hl9 h GLN 297 N 0.00 0.11 0.00 -0.52 7.50 -1.99 -0.13 115.11 120.08 3hl9 h GLN 297 Ca 0.18 -0.01 -0.04 0.00 0.50 0.00 0.00 58.65 59.28 3hl9 h GLN 297 Cb 0.42 -0.03 -0.01 0.00 0.05 0.00 0.00 27.48 27.92 3hl9 h GLN 297 CO -0.24 0.07 -0.21 1.79 -1.50 0.00 0.00 178.83 178.74 3hl9 h THR 298 N 0.11 0.41 -0.26 -0.54 1.35 0.83 -2.44 112.91 112.38 3hl9 h THR 298 Ca 0.08 -1.30 -0.11 0.00 -0.55 0.00 0.00 66.41 64.53 3hl9 h THR 298 Cb 0.07 1.97 -0.00 0.00 -1.73 0.00 0.00 68.15 68.46 3hl9 h THR 298 CO -0.10 0.20 -0.26 0.58 -0.25 0.00 0.00 175.52 175.69 3hl9 h VAL 299 N 0.00 1.31 -0.94 6.82 2.07 -1.11 -3.14 116.25 121.26 3hl9 h VAL 299 Ca -0.00 -1.43 0.16 0.00 0.82 0.00 0.00 66.70 66.26 3hl9 h VAL 299 Cb 0.95 1.64 -0.10 0.00 -1.52 0.00 0.00 31.29 32.27 3hl9 h VAL 299 CO 0.03 0.45 0.54 0.44 0.02 0.00 0.00 177.57 179.05 3hl9 h ASP 300 N 0.35 0.70 -0.59 0.57 3.32 -0.57 -0.65 116.42 119.55 3hl9 h ASP 300 Ca 0.04 0.09 0.07 0.00 0.02 0.00 0.00 57.03 57.25 3hl9 h ASP 300 Cb 0.82 -0.03 -0.06 0.00 0.22 0.00 0.00 39.33 40.28 3hl9 h ASP 300 CO 0.06 0.28 0.27 -0.07 -1.72 0.00 0.00 179.24 178.07 3hl9 h LEU 301 N 0.74 0.35 -1.15 1.55 3.38 -1.41 -1.24 115.31 117.52 3hl9 h LEU 301 Ca 0.52 0.05 0.22 0.00 0.09 0.00 0.00 57.88 58.76 3hl9 h LEU 301 Cb 0.75 -0.01 -0.10 0.00 0.09 0.00 0.00 40.66 41.39 3hl9 h LEU 301 CO -0.36 0.22 0.62 0.24 0.09 0.00 0.00 178.44 179.25 3hl9 h MET 302 N 0.50 0.60 -0.00 1.13 2.86 -1.10 0.12 114.93 119.04 3hl9 h MET 302 Ca 0.28 -0.04 0.00 0.00 -2.06 0.00 0.00 59.70 57.88 3hl9 h MET 302 Cb 0.26 -0.13 0.00 0.00 0.06 0.00 0.00 31.60 31.78 3hl9 h MET 302 CO -0.23 0.39 -0.18 1.19 1.06 0.00 0.00 176.91 179.14 3hl9 n PHE 303 N -4.72 0.00 -2.51 -0.22 3.01 -0.52 -1.57 117.46 110.93 3hl9 n PHE 303 Ca 0.24 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 58.28 3hl9 n PHE 303 Cb 0.68 -0.24 -0.03 0.00 -0.01 0.00 0.00 39.48 39.88 3hl9 n PHE 303 CO 0.00 0.00 0.00 -0.65 1.01 0.00 0.00 176.76 177.12 3hl9 s GLN 304 N -2.65 4.45 -0.45 -1.08 -1.52 0.41 -4.96 119.66 113.86 3hl9 s GLN 304 Ca 0.23 1.65 -0.27 0.00 -1.95 0.00 0.00 55.36 55.02 3hl9 s GLN 304 Cb 0.19 -3.42 -0.02 0.00 -0.22 0.00 0.00 33.01 29.54 3hl9 s GLN 304 CO 0.53 -0.25 1.87 -2.14 -0.25 0.00 0.00 175.29 175.05 3hl9 s PRO 305 N 1.32 2.96 0.39 2.91 0.02 -1.26 -4.42 135.00 136.93 3hl9 s PRO 305 Ca 0.56 1.10 0.21 0.00 0.02 0.00 0.00 61.00 62.89 3hl9 s PRO 305 Cb -0.26 -4.30 0.64 0.00 0.02 0.00 0.00 34.50 30.60 3hl9 s PRO 305 CO 0.27 -2.31 1.70 0.00 -0.33 0.00 0.00 177.00 176.33 3hl9 h ALA 306 N 14.20 0.93 -2.32 -1.55 0.00 -1.25 -3.46 119.26 125.81 3hl9 h ALA 306 Ca -0.30 -0.27 -0.55 0.00 0.00 0.00 0.00 54.91 53.79 3hl9 h ALA 306 Cb 1.17 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.91 3hl9 h ALA 306 CO 1.12 0.38 0.91 -0.51 0.00 0.00 0.00 179.25 181.15 3hl9 s LEU 307 N -6.70 4.30 0.85 0.00 2.01 -1.23 -4.99 118.68 112.91 3hl9 s LEU 307 Ca 0.02 2.10 -0.13 0.00 0.01 0.00 0.00 54.13 56.13 3hl9 s LEU 307 Cb 0.09 -3.55 0.06 0.00 0.01 0.00 0.00 46.19 42.80 3hl9 s LEU 307 CO 0.67 -0.79 0.85 -0.62 1.01 0.00 0.00 176.35 177.48 3hl9 n GLU 308 N 5.99 -0.05 -0.10 1.70 4.71 -1.26 -4.57 120.64 127.06 3hl9 n GLU 308 Ca 0.14 0.05 -0.07 0.00 -0.01 0.00 0.00 57.16 57.27 3hl9 n GLU 308 Cb 0.43 -2.16 0.01 0.00 -1.01 0.00 0.00 31.44 28.71 3hl9 n GLU 308 CO 0.00 0.00 0.00 -1.35 0.09 0.00 0.00 177.13 175.87 3hl9 h PRO 309 N -1.18 0.28 0.00 3.49 0.11 -1.99 0.17 132.00 132.89 3hl9 h PRO 309 Ca -0.45 -0.02 -0.13 0.00 0.11 0.00 0.00 66.00 65.52 3hl9 h PRO 309 Cb 1.30 -0.06 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 3hl9 h PRO 309 CO 0.41 0.19 -0.61 -0.09 -0.21 0.00 0.00 178.00 177.68 3hl9 h ARG 310 N 0.29 0.00 -0.13 1.05 1.12 -2.00 -2.66 114.38 112.05 3hl9 h ARG 310 Ca 0.15 0.00 -0.03 0.00 -1.11 0.00 0.00 59.98 58.99 3hl9 h ARG 310 Cb 0.10 0.00 -0.00 0.00 -0.01 0.00 0.00 29.97 30.06 3hl9 h ARG 310 CO -0.13 0.61 -0.04 -0.07 -3.11 0.00 0.00 179.97 177.23 3hl9 h LEU 311 N 0.00 0.25 -2.01 3.80 3.38 -1.77 -2.74 115.31 116.22 3hl9 h LEU 311 Ca -0.01 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.58 3hl9 h LEU 311 Cb 1.14 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.82 3hl9 h LEU 311 CO 0.08 0.58 -0.02 1.05 0.09 0.00 0.00 178.44 180.22 3hl9 h GLU 312 N -0.08 0.00 0.01 1.13 4.11 -0.55 -2.04 114.58 117.17 3hl9 h GLU 312 Ca 0.03 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.44 3hl9 h GLU 312 Cb 0.48 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.73 3hl9 h GLU 312 CO 0.01 0.02 -0.10 1.49 0.07 0.00 0.00 179.01 180.50 3hl9 h GLU 313 N 0.00 0.05 -0.08 1.06 4.22 -1.43 -2.59 114.58 115.81 3hl9 h GLU 313 Ca -0.00 -0.07 -0.00 0.00 0.08 0.00 0.00 59.36 59.37 3hl9 h GLU 313 Cb 0.33 0.02 -0.00 0.00 0.50 0.00 0.00 28.75 29.60 3hl9 h GLU 313 CO 0.00 0.96 0.04 -0.56 -2.18 0.00 0.00 179.01 177.27 3hl9 h GLN 314 N -0.83 0.11 0.34 1.92 -0.00 -1.29 -0.93 115.11 114.42 3hl9 h GLN 314 Ca -0.02 -0.01 -0.02 0.00 -0.00 0.00 0.00 58.65 58.61 3hl9 h GLN 314 Cb 1.00 -0.02 0.00 0.00 -0.00 0.00 0.00 27.48 28.46 3hl9 h GLN 314 CO 0.02 0.08 -0.16 1.98 -0.00 0.00 0.00 178.83 180.75 3hl9 h MET 315 N 0.11 -0.44 -0.72 0.06 4.05 -1.41 -0.38 114.93 116.20 3hl9 h MET 315 Ca 0.03 0.03 0.16 0.00 -0.28 0.00 0.00 59.70 59.64 3hl9 h MET 315 Cb 0.01 0.10 -0.12 0.00 -0.80 0.00 0.00 31.60 30.79 3hl9 h MET 315 CO -0.00 -0.12 0.09 -0.91 0.23 0.00 0.00 176.91 176.20 3hl9 h ASN 316 N -0.87 -0.17 -0.15 1.39 2.35 -1.13 0.17 115.58 117.18 3hl9 h ASN 316 Ca -0.05 0.17 0.01 0.00 -0.55 0.00 0.00 56.30 55.88 3hl9 h ASN 316 Cb 0.53 0.26 -0.02 0.00 0.05 0.00 0.00 38.32 39.15 3hl9 h ASN 316 CO 0.08 -0.11 0.05 1.56 -1.65 0.00 0.00 177.43 177.36 3hl9 h GLN 317 N 0.18 0.12 0.34 0.81 4.20 -1.10 0.61 115.11 120.27 3hl9 h GLN 317 Ca 0.40 -0.01 -0.01 0.00 0.06 0.00 0.00 58.65 59.09 3hl9 h GLN 317 Cb 0.69 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.44 3hl9 h GLN 317 CO -0.57 0.08 -0.22 1.25 -0.67 0.00 0.00 178.83 178.70 3hl9 h HIS 318 N 0.12 -0.57 -0.47 2.96 2.76 0.13 -1.27 115.15 118.82 3hl9 h HIS 318 Ca 0.06 -0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.20 3hl9 h HIS 318 Cb 0.04 0.20 -0.02 0.00 1.55 0.00 0.00 27.41 29.18 3hl9 h HIS 318 CO -0.11 -0.34 0.19 0.52 -1.30 0.00 0.00 177.93 176.89 3hl9 h MET 319 N -0.54 0.66 -0.36 5.26 2.86 -0.47 -0.60 114.93 121.74 3hl9 h MET 319 Ca -0.03 -0.09 -0.06 0.00 -2.06 0.00 0.00 59.70 57.46 3hl9 h MET 319 Cb 0.45 -0.12 -0.01 0.00 0.06 0.00 0.00 31.60 31.97 3hl9 h MET 319 CO 0.03 0.55 0.00 -0.44 1.06 0.00 0.00 176.91 178.11 3hl9 h ASP 320 N 0.66 0.61 0.72 1.22 3.32 -0.72 -3.01 116.42 119.22 3hl9 h ASP 320 Ca 0.16 -0.31 0.00 0.00 0.02 0.00 0.00 57.03 56.91 3hl9 h ASP 320 Cb 0.13 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.52 3hl9 h ASP 320 CO -0.02 0.77 0.00 0.00 -1.72 0.00 0.00 179.24 178.27 3hl9 h ALA 321 N 0.87 1.00 -2.58 3.45 0.00 0.03 -3.32 119.26 118.71 3hl9 h ALA 321 Ca 0.10 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.36 3hl9 h ALA 321 Cb 0.45 0.00 -0.39 0.00 0.00 0.00 0.00 17.79 17.85 3hl9 h ALA 321 CO 0.02 0.00 -0.32 -1.13 0.00 0.00 0.00 179.25 177.82 3hl9 n SER 322 N -2.67 3.95 0.22 0.00 3.41 -0.37 -4.86 113.62 113.31 3hl9 n SER 322 Ca 0.01 -3.30 0.12 0.00 -0.26 0.00 0.00 58.87 55.43 3hl9 n SER 322 Cb 0.23 -0.85 0.29 0.00 -0.26 0.00 0.00 64.21 63.62 3hl9 n SER 322 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 3hl9 h PRO 323 N 5.09 0.00 0.00 4.33 0.13 -1.73 -2.55 132.00 137.27 3hl9 h PRO 323 Ca 0.18 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.24 3hl9 h PRO 323 Cb 0.72 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 3hl9 h PRO 323 CO 0.86 0.09 -0.33 1.12 -0.23 0.00 0.00 178.00 179.51 3hl9 h HIS 324 N 0.00 0.00 0.00 1.56 2.07 -1.94 -3.22 115.15 113.62 3hl9 h HIS 324 Ca -0.00 0.00 -0.06 0.00 -2.85 0.00 0.00 60.37 57.45 3hl9 h HIS 324 Cb 0.92 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.89 3hl9 h HIS 324 CO 0.00 0.33 -0.42 0.82 -3.07 0.00 0.00 177.93 175.59 3hl9 h ILE 325 N 0.00 0.96 -5.78 6.12 2.04 -1.94 -3.49 117.51 115.42 3hl9 h ILE 325 Ca -0.00 -1.86 -0.15 0.00 1.00 0.00 0.00 64.86 63.85 3hl9 h ILE 325 Cb 0.65 1.96 0.00 0.00 -0.74 0.00 0.00 36.82 38.69 3hl9 h ILE 325 CO 0.04 0.33 -0.46 -3.20 0.00 0.00 0.00 178.15 174.86 3hl9 n ASN 326 N -4.59 -6.96 0.10 1.72 5.15 -0.97 -4.84 115.26 104.87 3hl9 n ASN 326 Ca -0.14 -0.16 0.03 0.00 -0.60 0.00 0.00 54.58 53.71 3hl9 n ASN 326 Cb 0.41 -4.17 0.42 0.00 -0.53 0.00 0.00 39.78 35.92 3hl9 n ASN 326 CO 0.00 0.00 0.00 1.88 1.40 0.00 0.00 177.26 180.54 3hl9 h TYR 327 N 0.75 0.31 -0.65 1.20 -1.99 -1.90 -2.82 116.97 111.88 3hl9 h TYR 327 Ca -0.20 -0.02 -0.01 0.00 2.00 0.00 0.00 58.73 60.51 3hl9 h TYR 327 Cb 1.13 -0.10 -0.03 0.00 2.00 0.00 0.00 36.73 39.73 3hl9 h TYR 327 CO 0.17 0.32 0.37 0.78 -0.00 0.00 0.00 178.16 179.80 3hl9 h GLY 328 N 0.60 0.95 0.00 3.88 0.00 -1.90 -3.45 103.07 103.15 3hl9 h GLY 328 Ca 0.07 -0.40 0.00 0.00 0.00 0.00 0.00 47.33 47.00 3hl9 h GLY 328 CO 0.00 0.39 0.00 0.61 0.00 0.00 0.00 176.54 177.54 3hl9 n GLY 329 N -1.28 2.06 0.06 4.60 0.00 -1.07 -3.43 105.19 106.13 3hl9 n GLY 329 Ca 0.06 -0.13 0.11 0.00 0.00 0.00 0.00 46.02 46.07 3hl9 n GLY 329 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 3hl9 n PRO 330 N 0.00 0.50 -3.06 1.61 -0.04 -1.26 -4.95 135.00 127.80 3hl9 n PRO 330 Ca 0.00 -0.01 -0.32 0.00 -0.04 0.00 0.00 63.50 63.14 3hl9 n PRO 330 Cb 0.00 -1.66 -0.05 0.00 -0.04 0.00 0.00 33.50 31.75 3hl9 n PRO 330 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3hl9 s MET 331 N -3.34 3.90 0.04 0.54 0.23 -1.22 -4.85 119.30 114.61 3hl9 s MET 331 Ca -0.01 0.56 -0.23 0.00 -1.03 0.00 0.00 55.69 54.98 3hl9 s MET 331 Cb 0.13 -2.43 -0.12 0.00 -1.53 0.00 0.00 34.83 30.87 3hl9 s MET 331 CO 0.83 0.10 0.57 -2.30 -2.03 0.00 0.00 175.02 172.18 3hl9 n PRO 332 N -0.71 0.00 -0.19 3.16 -0.02 -1.26 -4.86 135.00 131.12 3hl9 n PRO 332 Ca 0.03 0.00 -0.08 0.00 -2.02 0.00 0.00 63.50 61.43 3hl9 n PRO 332 Cb 0.53 -0.86 0.02 0.00 -0.02 0.00 0.00 33.50 33.17 3hl9 n PRO 332 CO 0.00 0.00 0.00 0.52 1.98 0.00 0.00 175.50 178.00 3hl9 h MET 333 N 1.50 0.79 -5.06 -0.52 2.86 -1.95 -3.36 114.93 109.18 3hl9 h MET 333 Ca -0.28 -0.13 -0.63 0.00 -2.06 0.00 0.00 59.70 56.60 3hl9 h MET 333 Cb 0.93 -0.13 -0.15 0.00 0.06 0.00 0.00 31.60 32.30 3hl9 h MET 333 CO 0.40 0.68 -0.44 0.08 1.06 0.00 0.00 176.91 178.69 3hl9 s VAL 334 N -5.60 5.30 0.07 -2.22 1.01 -1.26 -4.69 120.40 113.01 3hl9 s VAL 334 Ca -0.13 0.28 -0.25 0.00 0.00 0.00 0.00 61.98 61.88 3hl9 s VAL 334 Cb 0.12 -3.56 0.07 0.00 0.00 0.00 0.00 36.38 33.00 3hl9 s VAL 334 CO 0.78 0.28 0.61 -0.22 0.00 0.00 0.00 175.10 176.54 3hl9 s LEU 335 N 1.48 -0.50 -0.36 3.92 0.20 -1.26 -5.12 118.68 117.04 3hl9 s LEU 335 Ca 0.10 0.26 -0.17 0.00 0.69 0.00 0.00 54.13 55.00 3hl9 s LEU 335 Cb -0.15 2.48 -0.00 0.00 -0.43 0.00 0.00 46.19 48.10 3hl9 s LEU 335 CO 0.08 -0.81 0.45 -0.60 -0.29 0.00 0.00 176.35 175.18 3hl9 s ARG 336 N -2.70 3.49 0.28 1.98 3.52 -1.26 -4.97 118.95 119.29 3hl9 s ARG 336 Ca -0.04 -0.38 0.04 0.00 -0.13 0.00 0.00 55.73 55.23 3hl9 s ARG 336 Cb -0.01 -3.84 -0.06 0.00 -1.56 0.00 0.00 34.95 29.48 3hl9 s ARG 336 CO -0.04 -0.65 0.01 1.03 -0.81 0.00 0.00 175.30 174.84 3hl9 s ARG 337 N 2.22 1.53 0.00 5.12 3.00 -1.26 -1.68 118.95 127.88 3hl9 s ARG 337 Ca 0.15 -1.81 0.00 0.00 0.00 0.00 0.00 55.73 54.07 3hl9 s ARG 337 Cb -0.16 -0.87 0.00 0.00 0.00 0.00 0.00 34.95 33.92 3hl9 s ARG 337 CO 0.13 -0.10 0.00 0.45 0.00 0.00 0.00 175.30 175.78 3hl9 n SER 338 N -0.58 0.81 -4.05 0.23 2.88 -0.12 -4.71 113.62 108.08 3hl9 n SER 338 Ca -0.04 -0.62 -0.13 0.00 -1.33 0.00 0.00 58.87 56.76 3hl9 n SER 338 Cb 0.65 0.00 -0.12 0.00 -0.75 0.00 0.00 64.21 63.99 3hl9 n SER 338 CO 0.00 0.00 0.00 0.12 -1.23 0.00 0.00 175.04 173.93 3hl9 s PHE 339 N -1.05 0.61 0.00 0.66 2.19 -1.26 -0.81 117.98 118.31 3hl9 s PHE 339 Ca 0.00 -0.48 0.00 0.00 0.33 0.00 0.00 56.93 56.78 3hl9 s PHE 339 Cb 0.00 -0.37 0.00 0.00 -1.31 0.00 0.00 43.02 41.34 3hl9 s PHE 339 CO 0.00 -0.09 0.00 0.41 1.83 0.00 0.00 175.22 177.37 3hl9 n GLY 340 N 1.58 1.90 2.87 13.12 0.00 -0.73 -0.78 105.19 123.14 3hl9 n GLY 340 Ca -0.22 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.51 3hl9 n GLY 340 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hl9 s LEU 341 N 0.00 4.17 0.00 0.99 1.43 -0.61 -4.41 118.68 120.25 3hl9 s LEU 341 Ca 0.00 -3.34 0.00 0.00 -1.03 0.00 0.00 54.13 49.76 3hl9 s LEU 341 Cb 0.00 -1.49 0.00 0.00 0.03 0.00 0.00 46.19 44.73 3hl9 s LEU 341 CO 0.00 -0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.02 3hl9 n GLY 342 N 2.65 1.31 0.00 -3.19 0.00 -1.26 -4.76 105.19 99.95 3hl9 n GLY 342 Ca 0.13 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.15 3hl9 n GLY 342 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3hl9 n GLY 343 N 0.00 1.42 3.84 -0.02 0.00 -1.26 -4.60 105.19 104.56 3hl9 n GLY 343 Ca 0.00 -0.88 -0.34 0.00 0.00 0.00 0.00 46.02 44.80 3hl9 n GLY 343 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3hl9 s ILE 344 N -2.57 4.62 -0.13 -0.61 -1.09 0.11 -1.77 121.20 119.75 3hl9 s ILE 344 Ca 0.00 1.10 0.02 0.00 -2.23 0.00 0.00 60.65 59.54 3hl9 s ILE 344 Cb 0.00 -3.69 0.01 0.00 -1.58 0.00 0.00 42.46 37.20 3hl9 s ILE 344 CO 0.00 -0.07 -0.20 -0.63 -1.23 0.00 0.00 174.94 172.82 3hl9 s ILE 345 N -1.85 1.87 -0.42 2.92 1.01 0.01 -0.83 121.20 123.91 3hl9 s ILE 345 Ca 0.51 -0.86 -0.28 0.00 0.00 0.00 0.00 60.65 60.02 3hl9 s ILE 345 Cb -0.12 -1.67 -0.01 0.00 0.01 0.00 0.00 42.46 40.66 3hl9 s ILE 345 CO 0.18 0.51 1.73 0.00 0.00 0.00 0.00 174.94 177.37 3hl9 s ALA 346 N 0.90 2.73 0.14 9.38 0.00 -0.79 -0.95 121.76 133.18 3hl9 s ALA 346 Ca -0.06 -0.07 -0.08 0.00 0.00 0.00 0.00 51.96 51.75 3hl9 s ALA 346 Cb -0.15 -4.08 -0.04 0.00 0.00 0.00 0.00 23.12 18.85 3hl9 s ALA 346 CO -0.02 -2.91 1.40 -0.07 0.00 0.00 0.00 175.76 174.15 3hl9 h LEU 347 N 14.08 0.79-10.44 0.00 3.38 -1.64 -2.02 115.31 119.46 3hl9 h LEU 347 Ca -0.30 -0.48 -0.54 0.00 0.09 0.00 0.00 57.88 56.65 3hl9 h LEU 347 Cb 1.15 -0.23 -0.02 0.00 0.09 0.00 0.00 40.66 41.65 3hl9 h LEU 347 CO 1.09 1.25 -0.24 -1.83 0.09 0.00 0.00 178.44 178.80 3hl9 s GLU 348 N -3.86 2.30 -0.08 1.13 -1.05 -1.18 -4.70 118.70 111.26 3hl9 s GLU 348 Ca -0.09 -1.84 -0.25 0.00 -0.15 0.00 0.00 54.97 52.64 3hl9 s GLU 348 Cb 0.10 -2.32 -0.03 0.00 -0.44 0.00 0.00 34.13 31.44 3hl9 s GLU 348 CO 0.88 -0.66 0.78 0.34 0.95 0.00 0.00 175.26 177.54 3hl9 s ASP 349 N -4.40 7.05 0.21 0.83 -1.08 -1.26 -3.80 116.67 114.21 3hl9 s ASP 349 Ca 0.45 1.27 -0.06 0.00 -0.52 0.00 0.00 52.55 53.68 3hl9 s ASP 349 Cb -0.04 -2.45 0.17 0.00 -1.46 0.00 0.00 42.92 39.15 3hl9 s ASP 349 CO 0.28 -0.21 1.71 -0.07 0.52 0.00 0.00 175.17 177.40 3hl9 h LEU 350 N 7.14 0.98 -5.00 -1.34 4.07 -1.78 -3.40 115.31 115.98 3hl9 h LEU 350 Ca -0.38 -0.24 -0.10 0.00 0.08 0.00 0.00 57.88 57.24 3hl9 h LEU 350 Cb 1.19 -0.26 -0.16 0.00 1.08 0.00 0.00 40.66 42.51 3hl9 h LEU 350 CO 0.77 0.99 -0.36 -0.67 -1.08 0.00 0.00 178.44 178.09 3hl9 n ASP 351 N -4.21 -2.75 0.00 -0.43 2.03 -1.26 -4.97 116.55 104.96 3hl9 n ASP 351 Ca 0.04 -2.25 0.00 0.00 0.52 0.00 0.00 54.79 53.10 3hl9 n ASP 351 Cb 0.30 1.40 0.00 0.00 -0.72 0.00 0.00 41.12 42.10 3hl9 n ASP 351 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 3hl9 n GLY 352 N 2.77 2.58 0.92 0.27 0.00 -1.26 -1.61 105.19 108.86 3hl9 n GLY 352 Ca 0.15 -0.31 0.10 0.00 0.00 0.00 0.00 46.02 45.96 3hl9 n GLY 352 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3hl9 n GLU 353 N 14.00 2.18 0.12 1.61 4.71 -1.26 -4.32 120.64 137.68 3hl9 n GLU 353 Ca 0.00 -1.80 -0.18 0.00 -0.01 0.00 0.00 57.16 55.16 3hl9 n GLU 353 Cb 0.00 -1.43 -0.15 0.00 -1.01 0.00 0.00 31.44 28.85 3hl9 n GLU 353 CO 0.00 0.00 0.00 -0.91 0.09 0.00 0.00 177.13 176.31 3hl9 h ASN 354 N 3.21 0.55 -0.08 1.62 4.21 -1.72 -3.48 115.58 119.89 3hl9 h ASN 354 Ca 0.00 -0.59 0.00 0.00 1.21 0.00 0.00 56.30 56.92 3hl9 h ASN 354 Cb 0.72 -0.18 0.00 0.00 -1.12 0.00 0.00 38.32 37.74 3hl9 h ASN 354 CO 0.00 1.46 0.00 1.87 -1.29 0.00 0.00 177.43 179.47 3hl9 n TRP 355 N -3.58 0.00 -1.36 1.19 -0.00 -1.17 -4.52 117.44 107.99 3hl9 n TRP 355 Ca -0.11 0.00 -0.35 0.00 -0.00 0.00 0.00 57.50 57.04 3hl9 n TRP 355 Cb 1.05 0.00 0.10 0.00 -0.00 0.00 0.00 31.31 32.46 3hl9 n TRP 355 CO 0.00 0.00 0.00 0.54 -0.00 0.00 0.00 177.69 178.23 3hl9 n ARG 356 N 0.00 0.55 -4.24 5.87 1.74 -1.26 -4.81 116.66 114.51 3hl9 n ARG 356 Ca 0.00 0.25 -0.28 0.00 -0.77 0.00 0.00 57.85 57.05 3hl9 n ARG 356 Cb 0.00 -2.37 -0.09 0.00 -1.02 0.00 0.00 32.46 28.98 3hl9 n ARG 356 CO 0.00 0.00 0.00 1.03 -1.52 0.00 0.00 177.63 177.14 3hl9 s ARG 357 N -3.60 2.18 -0.05 5.56 1.81 -1.26 -2.29 118.95 121.30 3hl9 s ARG 357 Ca 0.76 -1.14 -0.39 0.00 -1.72 0.00 0.00 55.73 53.24 3hl9 s ARG 357 Cb -0.34 -2.26 -0.19 0.00 -0.45 0.00 0.00 34.95 31.71 3hl9 s ARG 357 CO 0.48 0.46 1.06 1.17 -0.68 0.00 0.00 175.30 177.80 3hl9 n LYS 358 N 0.21 0.00 0.00 3.54 4.81 -1.25 -1.62 118.16 123.84 3hl9 n LYS 358 Ca -0.11 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.33 3hl9 n LYS 358 Cb 0.54 -1.42 0.00 0.00 0.02 0.00 0.00 35.03 34.17 3hl9 n LYS 358 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3hl9 n GLY 359 N 1.65 2.90 3.77 3.14 0.00 -0.76 -4.78 105.19 111.11 3hl9 n GLY 359 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 3hl9 n GLY 359 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 3hl9 s SER 360 N -1.31 6.25 -0.26 1.61 1.04 -0.64 -4.73 113.70 115.66 3hl9 s SER 360 Ca 0.00 2.83 -0.01 0.00 0.48 0.00 0.00 55.95 59.24 3hl9 s SER 360 Cb 0.00 -2.65 0.03 0.00 0.10 0.00 0.00 66.02 63.50 3hl9 s SER 360 CO 0.00 -0.91 -0.05 -0.22 0.98 0.00 0.00 173.24 173.03 3hl9 s LEU 361 N -2.36 3.33 0.19 2.42 2.96 0.36 -1.88 118.68 123.69 3hl9 s LEU 361 Ca 0.56 -0.98 0.09 0.00 -0.22 0.00 0.00 54.13 53.58 3hl9 s LEU 361 Cb -0.42 -1.66 -0.04 0.00 0.50 0.00 0.00 46.19 44.57 3hl9 s LEU 361 CO 0.55 -0.16 -0.08 0.28 -1.32 0.00 0.00 176.35 175.62 3hl9 s THR 362 N 1.30 3.23 0.26 3.68 -1.32 -0.01 -1.24 115.64 121.54 3hl9 s THR 362 Ca -0.01 -1.68 -0.08 0.00 -1.21 0.00 0.00 61.69 58.70 3hl9 s THR 362 Cb -0.17 -2.62 0.03 0.00 -1.51 0.00 0.00 72.50 68.23 3hl9 s THR 362 CO -0.04 -0.14 0.49 0.33 -2.21 0.00 0.00 174.62 173.05 3hl9 n PHE 363 N -0.07 -1.73 -3.83 9.09 7.35 -1.10 0.07 117.46 127.24 3hl9 n PHE 363 Ca -0.10 -1.37 -0.05 0.00 -0.76 0.00 0.00 57.45 55.17 3hl9 n PHE 363 Cb 0.56 0.57 0.02 0.00 0.35 0.00 0.00 39.48 40.98 3hl9 n PHE 363 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 3hl9 n GLY 364 N -0.38 0.77 3.40 7.13 0.00 -1.26 -1.77 105.19 113.07 3hl9 n GLY 364 Ca -0.04 -1.17 -0.20 0.00 0.00 0.00 0.00 46.02 44.60 3hl9 n GLY 364 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3hl9 s GLY 365 N -3.24 1.63 0.02 -0.02 0.00 0.21 -4.18 107.32 101.74 3hl9 s GLY 365 Ca 0.20 -1.77 -0.03 0.00 0.00 0.00 0.00 44.72 43.11 3hl9 s GLY 365 CO 0.07 -1.83 0.52 0.61 0.00 0.00 0.00 173.10 172.48 3hl9 n GLY 366 N -0.49 -1.43 1.88 0.20 0.00 -1.26 -2.07 105.19 102.02 3hl9 n GLY 366 Ca -0.07 0.34 -0.02 0.00 0.00 0.00 0.00 46.02 46.27 3hl9 n GLY 366 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 3hl9 n PRO 367 N -2.91 0.70 -2.37 1.61 -0.02 -1.26 -3.33 135.00 127.42 3hl9 n PRO 367 Ca 0.00 -0.16 -0.20 0.00 -2.02 0.00 0.00 63.50 61.12 3hl9 n PRO 367 Cb 0.03 -1.39 -0.01 0.00 -0.02 0.00 0.00 33.50 32.10 3hl9 n PRO 367 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 3hl9 n ASN 368 N 2.03 -5.62 -4.69 2.55 3.02 -0.96 -3.12 115.26 108.47 3hl9 n ASN 368 Ca 0.07 0.03 -0.42 0.00 -0.03 0.00 0.00 54.58 54.24 3hl9 n ASN 368 Cb 0.34 -4.70 -0.03 0.00 -0.61 0.00 0.00 39.78 34.78 3hl9 n ASN 368 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 3hl9 s ILE 369 N -2.97 4.87 -0.04 2.41 1.01 -0.88 -4.08 121.20 121.51 3hl9 s ILE 369 Ca 0.00 1.88 -0.02 0.00 0.00 0.00 0.00 60.65 62.51 3hl9 s ILE 369 Cb 0.00 -4.24 0.03 0.00 0.01 0.00 0.00 42.46 38.26 3hl9 s ILE 369 CO 0.00 0.09 0.07 0.54 0.00 0.00 0.00 174.94 175.64 3hl9 s VAL 370 N 1.57 -0.11 0.34 2.92 0.11 -0.68 0.67 120.40 125.21 3hl9 s VAL 370 Ca 0.46 0.38 0.08 0.00 -2.93 0.00 0.00 61.98 59.97 3hl9 s VAL 370 Cb -0.19 -0.15 -0.04 0.00 -1.53 0.00 0.00 36.38 34.47 3hl9 s VAL 370 CO 0.20 0.16 0.12 -1.66 -3.33 0.00 0.00 175.10 170.59 3hl9 s TRP 371 N 1.95 2.69 -0.27 1.54 1.48 -0.73 -1.16 118.94 124.44 3hl9 s TRP 371 Ca 0.02 -0.38 -0.24 0.00 -1.06 0.00 0.00 56.10 54.43 3hl9 s TRP 371 Cb -0.12 -1.61 0.08 0.00 -1.16 0.00 0.00 33.47 30.66 3hl9 s TRP 371 CO -0.03 0.37 0.79 1.14 -4.06 0.00 0.00 176.95 175.15 3hl9 s GLN 372 N -3.82 0.75 -0.18 3.25 1.03 -0.06 -2.70 119.66 117.94 3hl9 s GLN 372 Ca 0.37 0.92 -0.01 0.00 0.04 0.00 0.00 55.36 56.68 3hl9 s GLN 372 Cb -0.02 0.36 0.00 0.00 0.03 0.00 0.00 33.01 33.37 3hl9 s GLN 372 CO 0.22 -0.09 -0.12 0.42 -2.54 0.00 0.00 175.29 173.17 3hl9 s ILE 373 N 0.42 2.79 -0.37 3.63 -1.09 -0.37 -1.41 121.20 124.80 3hl9 s ILE 373 Ca 0.00 -0.71 0.03 0.00 -2.23 0.00 0.00 60.65 57.74 3hl9 s ILE 373 Cb -0.05 -2.21 0.11 0.00 -1.58 0.00 0.00 42.46 38.72 3hl9 s ILE 373 CO -0.02 0.49 0.10 -0.62 -1.23 0.00 0.00 174.94 173.67 3hl9 s ASP 374 N 1.14 4.83 0.17 3.58 -1.08 0.42 -0.49 116.67 125.24 3hl9 s ASP 374 Ca 0.01 -2.23 -0.07 0.00 -0.52 0.00 0.00 52.55 49.74 3hl9 s ASP 374 Cb -0.14 -1.67 0.04 0.00 -1.46 0.00 0.00 42.92 39.68 3hl9 s ASP 374 CO -0.04 -0.40 1.49 -0.65 0.52 0.00 0.00 175.17 176.09 3hl9 h PRO 375 N 7.58 0.76 -0.11 4.34 0.11 -1.85 -0.96 132.00 141.87 3hl9 h PRO 375 Ca -0.06 -0.43 -0.10 0.00 0.11 0.00 0.00 66.00 65.52 3hl9 h PRO 375 Cb 1.01 0.03 -0.01 0.00 0.11 0.00 0.00 31.00 32.14 3hl9 h PRO 375 CO 0.57 1.06 -0.36 -0.22 -0.21 0.00 0.00 178.00 178.84 3hl9 h LYS 376 N 0.60 0.23 0.00 1.05 3.64 -1.92 -2.52 116.57 117.66 3hl9 h LYS 376 Ca 0.03 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 3hl9 h LYS 376 Cb 1.04 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.85 3hl9 h LYS 376 CO 0.10 0.57 -0.29 0.00 -2.27 0.00 0.00 179.45 177.55 3hl9 n ALA 377 N -2.48 2.77 -1.40 5.00 0.00 -1.19 -4.94 120.51 118.28 3hl9 n ALA 377 Ca -0.01 -0.18 -0.08 0.00 0.00 0.00 0.00 53.44 53.16 3hl9 n ALA 377 Cb 0.44 -1.30 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 3hl9 n ALA 377 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3hl9 n GLY 378 N 1.41 0.85 3.38 0.00 0.00 -0.46 -4.99 105.19 105.38 3hl9 n GLY 378 Ca 0.05 -0.64 -0.19 0.00 0.00 0.00 0.00 46.02 45.24 3hl9 n GLY 378 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3hl9 s LEU 379 N -1.98 2.49 -0.16 0.99 1.43 -0.61 -0.91 118.68 119.92 3hl9 s LEU 379 Ca 0.00 -1.12 -0.08 0.00 -1.03 0.00 0.00 54.13 51.90 3hl9 s LEU 379 Cb 0.00 -0.61 0.06 0.00 0.03 0.00 0.00 46.19 45.67 3hl9 s LEU 379 CO 0.00 -0.29 0.38 0.00 0.23 0.00 0.00 176.35 176.67 3hl9 s THR 381 N 1.73 1.76 -0.19 0.00 -4.23 -0.50 -2.03 115.64 112.18 3hl9 s THR 381 Ca -0.07 -1.91 -0.04 0.00 -1.18 0.00 0.00 61.69 58.49 3hl9 s THR 381 Cb -0.10 -1.82 0.08 0.00 1.34 0.00 0.00 72.50 72.01 3hl9 s THR 381 CO -0.12 -0.34 0.20 -0.22 -0.54 0.00 0.00 174.62 173.60 3hl9 s LEU 382 N -2.67 -0.03 -0.19 4.79 2.96 -0.24 -0.88 118.68 122.42 3hl9 s LEU 382 Ca 0.15 -0.24 -0.11 0.00 -0.22 0.00 0.00 54.13 53.71 3hl9 s LEU 382 Cb -0.05 0.28 -0.05 0.00 0.50 0.00 0.00 46.19 46.87 3hl9 s LEU 382 CO 0.06 -0.32 0.19 0.00 -1.32 0.00 0.00 176.35 174.95 3hl9 s ALA 383 N 2.30 3.65 -0.21 5.97 0.00 -0.31 -1.65 121.76 131.51 3hl9 s ALA 383 Ca 0.06 -0.62 0.00 0.00 0.00 0.00 0.00 51.96 51.40 3hl9 s ALA 383 Cb -0.16 -2.25 0.05 0.00 0.00 0.00 0.00 23.12 20.76 3hl9 s ALA 383 CO -0.11 0.11 -0.06 0.12 0.00 0.00 0.00 175.76 175.83 3hl9 s PHE 384 N 0.44 2.13 0.39 0.00 2.19 0.04 -1.69 117.98 121.48 3hl9 s PHE 384 Ca 0.11 -1.49 0.07 0.00 0.33 0.00 0.00 56.93 55.94 3hl9 s PHE 384 Cb -0.12 -1.49 -0.08 0.00 -1.31 0.00 0.00 43.02 40.03 3hl9 s PHE 384 CO 0.00 -0.72 0.01 -0.06 1.83 0.00 0.00 175.22 176.28 3hl9 s PHE 385 N 1.49 2.39 -0.35 10.12 0.08 -1.26 -1.54 117.98 128.91 3hl9 s PHE 385 Ca -0.03 -0.71 0.14 0.00 0.12 0.00 0.00 56.93 56.45 3hl9 s PHE 385 Cb -0.17 -1.64 0.45 0.00 -0.57 0.00 0.00 43.02 41.09 3hl9 s PHE 385 CO -0.07 0.38 1.03 1.04 -0.10 0.00 0.00 175.22 177.50 3hl9 n GLN 386 N -0.89 2.06 -4.82 0.44 1.13 -1.24 -4.51 117.38 109.55 3hl9 n GLN 386 Ca -0.05 -3.73 -0.27 0.00 -1.94 0.00 0.00 57.00 51.02 3hl9 n GLN 386 Cb 0.66 -1.65 -0.16 0.00 0.11 0.00 0.00 30.24 29.20 3hl9 n GLN 386 CO 0.00 0.00 0.00 -1.17 -1.44 0.00 0.00 177.06 174.45 3hl9 s LEU 387 N -3.33 1.84 0.13 1.08 2.96 -1.18 -2.30 118.68 117.88 3hl9 s LEU 387 Ca 0.35 -0.37 0.05 0.00 -0.22 0.00 0.00 54.13 53.94 3hl9 s LEU 387 Cb 0.43 -1.00 -0.04 0.00 0.50 0.00 0.00 46.19 46.08 3hl9 s LEU 387 CO -0.04 0.11 0.08 -1.61 -1.32 0.00 0.00 176.35 173.57 3hl9 s GLU 388 N 0.34 2.77 0.67 1.98 0.41 0.13 -3.57 118.70 121.42 3hl9 s GLU 388 Ca -0.11 -0.86 -0.03 0.00 -0.41 0.00 0.00 54.97 53.56 3hl9 s GLU 388 Cb -0.14 -2.61 0.07 0.00 -1.78 0.00 0.00 34.13 29.67 3hl9 s GLU 388 CO 0.04 0.51 0.94 -1.25 -0.49 0.00 0.00 175.26 175.01 3hl9 s PRO 389 N -2.79 2.11 0.73 0.39 0.04 -1.26 -1.92 135.00 132.30 3hl9 s PRO 389 Ca 0.29 -0.67 -0.16 0.00 0.04 0.00 0.00 61.00 60.51 3hl9 s PRO 389 Cb -0.11 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 32.09 3hl9 s PRO 389 CO 0.22 -1.16 0.51 1.87 0.04 0.00 0.00 177.00 178.48 3hl9 n TRP 390 N -2.73 -0.87 -3.40 0.56 -0.00 -1.21 -3.80 117.44 105.99 3hl9 n TRP 390 Ca 0.10 0.35 -0.21 0.00 -0.00 0.00 0.00 57.50 57.74 3hl9 n TRP 390 Cb 0.60 -1.91 0.06 0.00 -0.00 0.00 0.00 31.31 30.07 3hl9 n TRP 390 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 177.69 175.98 3hl9 n ASN 391 N -0.26 -6.14 -4.79 5.87 5.15 -1.26 -4.98 115.26 108.85 3hl9 n ASN 391 Ca 0.10 -0.81 -0.39 0.00 -0.60 0.00 0.00 54.58 52.88 3hl9 n ASN 391 Cb 0.50 -4.60 -0.06 0.00 -0.53 0.00 0.00 39.78 35.09 3hl9 n ASN 391 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 3hl9 s ASP 392 N -3.43 7.04 0.17 1.20 -1.08 -1.25 -4.99 116.67 114.34 3hl9 s ASP 392 Ca 0.46 1.24 -0.15 0.00 -0.52 0.00 0.00 52.55 53.58 3hl9 s ASP 392 Cb -0.10 -2.37 0.13 0.00 -1.46 0.00 0.00 42.92 39.12 3hl9 s ASP 392 CO 0.78 0.19 1.73 -0.65 0.52 0.00 0.00 175.17 177.74 3hl9 h PRO 393 N 5.03 0.23 -0.29 4.34 0.11 -1.94 0.11 132.00 139.59 3hl9 h PRO 393 Ca -0.47 -0.01 -0.13 0.00 0.11 0.00 0.00 66.00 65.50 3hl9 h PRO 393 Cb 1.21 -0.05 -0.00 0.00 0.11 0.00 0.00 31.00 32.26 3hl9 h PRO 393 CO 0.66 0.15 -0.31 -0.39 -0.21 0.00 0.00 178.00 177.90 3hl9 h VAL 394 N 0.23 1.30 -0.10 3.15 -1.51 -1.96 -0.80 116.25 116.55 3hl9 h VAL 394 Ca 0.21 -1.49 -0.01 0.00 -1.23 0.00 0.00 66.70 64.19 3hl9 h VAL 394 Cb 0.25 1.58 -0.00 0.00 -2.13 0.00 0.00 31.29 30.98 3hl9 h VAL 394 CO -0.26 0.48 0.04 0.00 -1.23 0.00 0.00 177.57 176.60 3hl9 h ARG 396 N 0.02 1.12 -0.60 0.00 2.43 -0.76 0.29 114.38 116.88 3hl9 h ARG 396 Ca 0.03 -0.07 -0.10 0.00 -0.81 0.00 0.00 59.98 59.04 3hl9 h ARG 396 Cb 0.15 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.43 3hl9 h ARG 396 CO -0.00 0.74 -0.00 0.22 -1.51 0.00 0.00 179.97 179.42 3hl9 h ASP 397 N 1.16 1.04 -0.20 -3.80 3.58 -0.79 0.81 116.42 118.22 3hl9 h ASP 397 Ca 0.33 -0.31 -0.17 0.00 0.42 0.00 0.00 57.03 57.30 3hl9 h ASP 397 Cb -0.09 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 40.68 3hl9 h ASP 397 CO -0.08 1.09 -0.55 -0.07 -2.88 0.00 0.00 179.24 176.76 3hl9 h LEU 398 N 0.96 0.83 0.00 2.28 4.07 -0.36 -2.24 115.31 120.85 3hl9 h LEU 398 Ca 0.17 -0.58 -0.00 0.00 0.08 0.00 0.00 57.88 57.55 3hl9 h LEU 398 Cb 0.56 -0.24 0.00 0.00 1.08 0.00 0.00 40.66 42.06 3hl9 h LEU 398 CO 0.03 1.26 -0.00 0.74 -1.08 0.00 0.00 178.44 179.39 3hl9 h THR 399 N 0.44 1.08 -0.72 0.22 2.02 -0.38 0.29 112.91 115.86 3hl9 h THR 399 Ca -0.01 -0.24 0.11 0.00 0.77 0.00 0.00 66.41 67.03 3hl9 h THR 399 Cb 1.16 1.25 -0.12 0.00 -1.74 0.00 0.00 68.15 68.70 3hl9 h THR 399 CO 0.12 0.06 -0.41 0.03 0.37 0.00 0.00 175.52 175.69 3hl9 h ARG 400 N -0.11 -0.13 0.00 6.66 2.47 -0.83 -1.05 114.38 121.40 3hl9 h ARG 400 Ca -0.00 0.01 0.00 0.00 -1.26 0.00 0.00 59.98 58.73 3hl9 h ARG 400 Cb 0.11 0.03 0.00 0.00 -1.65 0.00 0.00 29.97 28.46 3hl9 h ARG 400 CO 0.00 -0.09 -0.03 0.25 0.56 0.00 0.00 179.97 180.66 3hl9 n THR 401 N -5.42 0.50 0.19 2.04 -2.24 -0.85 -1.90 114.28 106.60 3hl9 n THR 401 Ca 0.04 -0.24 -0.12 0.00 -2.27 0.00 0.00 64.05 61.46 3hl9 n THR 401 Cb 0.36 -0.55 -0.07 0.00 -2.10 0.00 0.00 70.33 67.97 3hl9 n THR 401 CO 0.00 0.00 0.00 0.15 -0.57 0.00 0.00 175.07 174.65 3hl9 h PHE 402 N 0.00 -0.48 0.23 4.78 3.57 0.76 -2.91 116.94 122.89 3hl9 h PHE 402 Ca 0.00 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.48 3hl9 h PHE 402 Cb 0.70 0.16 0.00 0.00 2.79 0.00 0.00 35.95 39.60 3hl9 h PHE 402 CO 0.00 -0.15 -0.11 0.93 -2.23 0.00 0.00 178.31 176.75 3hl9 h GLU 403 N -0.95 -0.29 -1.00 1.11 5.08 -1.20 -2.36 114.58 114.97 3hl9 h GLU 403 Ca -0.05 0.02 0.33 0.00 -1.00 0.00 0.00 59.36 58.65 3hl9 h GLU 403 Cb 0.54 0.07 -0.18 0.00 0.50 0.00 0.00 28.75 29.67 3hl9 h GLU 403 CO 0.09 -0.15 0.21 0.45 -1.00 0.00 0.00 179.01 178.61 3hl9 h HIS 404 N -0.36 0.26 0.34 4.33 3.86 -1.51 0.13 115.15 122.20 3hl9 h HIS 404 Ca -0.03 0.06 -0.02 0.00 -1.16 0.00 0.00 60.37 59.22 3hl9 h HIS 404 Cb 0.28 0.05 0.00 0.00 1.06 0.00 0.00 27.41 28.80 3hl9 h HIS 404 CO -0.04 -0.45 -0.16 0.00 0.86 0.00 0.00 177.93 178.13 3hl9 h ALA 405 N 2.00 -0.45 0.00 2.45 0.00 -1.23 -2.52 119.26 119.51 3hl9 h ALA 405 Ca 0.69 -0.14 -0.03 0.00 0.00 0.00 0.00 54.91 55.43 3hl9 h ALA 405 Cb 1.60 0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.56 3hl9 h ALA 405 CO -0.88 -0.44 -0.15 -0.84 0.00 0.00 0.00 179.25 176.94 3hl9 h ILE 406 N -1.07 1.10 -0.74 0.00 -0.00 -1.28 -1.88 117.51 113.64 3hl9 h ILE 406 Ca -0.05 -0.53 -0.06 0.00 -0.00 0.00 0.00 64.86 64.23 3hl9 h ILE 406 Cb 0.43 1.29 -0.03 0.00 -0.00 0.00 0.00 36.82 38.50 3hl9 h ILE 406 CO 0.08 0.15 0.24 1.88 -0.00 0.00 0.00 178.15 180.49 3hl9 h TYR 407 N 0.00 1.18 0.24 0.16 -1.99 -1.05 -2.38 116.97 113.13 3hl9 h TYR 407 Ca -0.00 -0.11 -0.01 0.00 2.00 0.00 0.00 58.73 60.60 3hl9 h TYR 407 Cb 0.27 -0.34 0.00 0.00 2.00 0.00 0.00 36.73 38.66 3hl9 h TYR 407 CO 0.00 0.93 -0.12 0.00 -0.00 0.00 0.00 178.16 178.97 3hl9 h ALA 408 N 1.15 -0.32 -0.10 3.88 0.00 -0.90 -3.10 119.26 119.87 3hl9 h ALA 408 Ca 0.24 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.99 3hl9 h ALA 408 Cb 0.30 0.13 -0.05 0.00 0.00 0.00 0.00 17.79 18.17 3hl9 h ALA 408 CO -0.01 -0.40 -0.18 0.37 0.00 0.00 0.00 179.25 179.04 3hl9 h GLN 409 N -0.90 -0.23 0.12 0.00 4.15 -1.46 -2.83 115.11 113.96 3hl9 h GLN 409 Ca -0.03 0.02 0.01 0.00 0.77 0.00 0.00 58.65 59.41 3hl9 h GLN 409 Cb 0.50 0.05 -0.04 0.00 0.21 0.00 0.00 27.48 28.21 3hl9 h GLN 409 CO 0.05 -0.15 -0.46 -0.92 -1.93 0.00 0.00 178.83 175.42 3hl9 h TYR 410 N -0.24 -1.34 -0.43 3.99 3.20 -1.48 -2.69 116.97 117.98 3hl9 h TYR 410 Ca 0.09 0.03 0.00 0.00 3.14 0.00 0.00 58.73 61.99 3hl9 h TYR 410 Cb 0.36 0.57 0.00 0.00 1.54 0.00 0.00 36.73 39.20 3hl9 h TYR 410 CO -0.27 -0.53 0.00 0.00 -1.64 0.00 0.00 178.16 175.72 3hl9 n GLN 411 N -5.08 2.91 -1.43 1.82 10.64 -1.17 -4.25 117.38 120.82 3hl9 n GLN 411 Ca -0.08 -1.92 0.02 0.00 -1.83 0.00 0.00 57.00 53.20 3hl9 n GLN 411 Cb 0.36 -1.72 0.01 0.00 -0.86 0.00 0.00 30.24 28.03 3hl9 n GLN 411 CO 0.00 0.00 0.00 1.04 -1.83 0.00 0.00 177.06 176.27 3hl9 n GLN 412 N 0.64 0.00 0.00 2.61 6.02 -1.02 -5.09 117.38 120.54 3hl9 n GLN 412 Ca 0.17 -1.86 0.05 0.00 -0.01 0.00 0.00 57.00 55.36 3hl9 n GLN 412 Cb 0.66 0.07 0.31 0.00 1.02 0.00 0.00 30.24 32.30 3hl9 n GLN 412 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46